Goran Neshich
Last General Update: June 07, 20171. Personal
Data
2. Professional
Qualifications
3. Education
History
4. Professional
Experience
5. Membership
To
6. Language
Competence
7. Publications
(Abstracts
from Entrez)
8. Work
Presented At Scientific Meetings
9. Thesis
Committee Participation
10. Software
Packages Published
11. Seminars
& Lectures given
12. Courses
13. Projects
14. Patents
15. Technical
Announcements
16. Awards
17. Professional
References
1.1.
Name: Goran Nesic
original name writing (Serbian):
U.S. documents annotation: Goran Neshich
Portuguese pronunciation: Góran Neshitch
(born in Beograd, Yugoslavia)
1.2. Professional:
Embrapa Informática Agropecuária
Caixa Postal 6041
Av. Dr. André Tosello No: 209
Barão Geraldo, Cidade Universitária "Zeferino Vaz"
CEP 13083-886 Campinas (SP) - Brazil
Telefone 55-19-3211-5774
FAX 55-19-3211-5754
E-mail: Goran.Neshich@embrapa.br
gneshich@gmail.com
http://www.cbi.cnptia.embrapa.br/~neshich/
Laboratory Management, Network Management, Software Design, Experiment
Design, Supervising and Teaching,
Scientific Society Management, Scientific Meeting Organization.
Computational Biology, BioInformatics, Structural Bioinformatics, Protein Engineering and Molecular Modeling, Agrochemical and Drug Design;
Computational Biology & BioInformatics:
-In Silico Chemogenomics
- Macromolecular Structure analysis, Macromolecular Surface analysis, Macromolecular
Complexes and their Interfaces
-Sequence analysis, Multiple Sequence Alignment, Structure Alignment
-Phylogenetic trees and Evaluation of Multiple Sequence and Structure Alignments
Based on Phylogenetic trees
-Software Manufacturing for Sequence, Structure and Surface Analysis
-Large Scale Automated Data-Base Consulting, Data Manipulation and Data
Generation, Relational Database of protein descriptors
In silico
-Agrochemical and Drug Design
-ADMET
-QSAR
-High Throughput Screening
Protein:
-Purification (including isolation from the membranes)
-Characterization
-Sequence analysis (including DNA sequences), data-bases
-Structure prediction and determination
-Structural analysis
-Molecular modeling, Homology modeling and Computer graphics
-Molecular mechanics and molecular dynamics calculations
-Protein design (Molecular Genetics, Site-directed mutagenesis)
-Protein stability: kinetic and thermodynamic analysis
-Modification and expression of proteins
Biochemistry:
-HPLC
-SDS/PAGE
-ion-exchange chromatography
-peptide and protein sequencing
Biophysics, Bioenergetics and Photosynthesis:
-Experimental studies on electron transport in photosynthesis, Flash photolysis;
Laser spectroscopy; Electronics; Quantum statistical mechanics
-EPR (spin labeling; membrane fluidity)
-fluorescence (including quenching)
-electrochemical measurements
-cryogenics
Protein-DNA interactions
-Simulation of Protein-DNA interactions (Molecular modeling; Sequence recognition)
Computer Networking, Data analysis, Statistics and Instrument interfacing:
-Networking (WAN and LAN), InterNet, TCP/IP, FTP
-WWW/Gopher document editing, organization and distribution
-UNIX, VMS and MS-DOS, MS-Windows and MS-Windows-NT operating systems
-software design (using Fortran, Forth, Basic, C++, Pearl, JAVA, JavaScript)
-molecular presentation software
-GPIB and RS-232 interfacing to instruments
3.1. Post-graduation:
Post Doctorate:
Biophysics - (1997-1998) University
of Columbia
Prof.
Barry Honig - Dept. Biochemistry & Molecular Biophysics, New York,
USA
Subject: Development of algorithms to describe macromolecular interfaces.
3.1.1. Ph.D.:
Biophysics - University
of Illinois at Urbana Champaign, Illinois, USA (1989)
Title of the thesis: "Biophysical Investigation of Electron Transfer between
High Potential Hemes in C Subunit and Special Pair
of Reaction Center Protein of Photosynthetic Bacteria Rhodopseudomonas viridis".
3.1.2. M.S.:
Plant Bio-physics - Center
for Multidisciplinary Studies, University
of Belgrade, Yugoslavia (1981).
Title of the thesis: "Influence of the Temperature on some Aspects of the
Photosynthetic Process and Membranes in
Maize (Zea mays L.)
3.2. B.S.:
3.2.1. Theoretical Physical-Chemistry
Faculty of Life Science and Mathematics, University
of Belgrade, Yugoslavia (1978)
Title of the thesis: "The Computation of the Energies and the Wave Functions
for the Bending Vibrations of Three-atomic
Molecules using Variation Method".
3.3. Other courses:
3.3.1. United Nations Environment Program (UNEP)
course "Studies on Photosynthesis in Relation to Bioproductivity", chief
coordinator Dr. David 0. Hall, King's College, University of London, U.K.,
conducted in the Laboratory of Biophysics, Maize
Research Institute, Belgrade, Yugoslavia, July 15th to August 05, 1981.
3.4. Professional Contacts:
3.4.1. European Molecular Biology Laboratory (EMBL),
The EMBL data Library and Protein Design Group. Heidelberg - Germany.
3.4.2. RIKEN
Life Science Center, The RIKEN Data Library, Tsukuba - city, Japan.
3.4.3. University of Illinois at Urbana-Champaign, Department
of Biophysics and Beckman
Institute. U.S.A.
3.4.4. National Center of Biotechnology Information (NCBI)
Washington D.C., U.S.A.
3.4.5. International Center for Genetic Engineering and
Biotechnology (ICGEB),
Trieste, Italy
3.4.6. Brookhaven
National Laboratory, Protein Data Bank, Upton, New York, U.S.A.
3.4.7. Scripps
Institute, San Diego, USA
3.4.8. University
of Columbia, New York, New York, U.S.A.
3.4.9. Research Collaboratory for Structural Bioinformatics
(RCSB) PDB, SDSC,
UCSD, USA
3.4.10. CNB
Madrid, Spain
3.4.11. Kyushu
Institute of Technology, Japan
3.4.12. Scuola
Normale Superiore, Pisa, Italy
3.4.13. H.
Poincare University, Nancy, France
3.4.14.
Zentrum für Bioinformatik, Universität Hamburg, Germany
3.4.15. Facultad
de Ciencias Exactas, UNLP, Calles 49 y 115, 1900 La Plata, Argentina
3.4.16. Facultad de Ingeniería y Tecnologías, Universidad
Católica del Uruguay, Montevideo, Uruguay
3.4.17. Center for Biological Sequence Analysis - DTU
- Copenhagen - Denmark
3.4.18. Center
for Multidisciplinary Studies, University of Belgrade, Serbia
3.4.19. CBUC The Centre for Bioinformatics CBUC at the Faculty of
Biological Sciences at the
Pontificia Universidad Catolica de Chile, Santiago, Chile
3.4.20. IIT
Instituto Italiano de Tecnologia - Drug Discovery and Development, Italy
3.4.21. SGC
- Structural Genomics Consortium - Oxford, UK
4.1. 1979-1985: Maize
Research Institute, Zemun Polje, Belgrade, Yugoslavia.
4.1.1. Department of Physiology, Laboratory of Biophysics
4.1.2. Position: Research Associate
4.1.3. Project: "Computer Modeling of the Cell Membrane
Response to Environmental Stress"
4.2. 1983-1989: University
of Illinois at Urbana-Champaign, Illinois, USA.
4.2.1. Department of Biophysics, Laboratory of Molecular
Biophysics
4.2.2. Position: Research Assistant
4.2.3. Project: Bioenergetics of the photosynthetic processes.
4.3. 1988-1992: IICA/ (CENARGEN)/
EMBRAPA, Brasília, D.F., Brazil
4.3.1. Department of Molecular Biology, Laboratory for
Protein Engineering and Biophysics
4.3.2. Position: International Consultant for EMBRAPA/CENARGEN
through the Inter American Institute for Cooperation on Agriculture (IICA)
4.3.3. Project:
a) "Determination of the structure and the function of
the storage protein 2S from Bertholletia excelsa H.B.K. with parallel introduction
of tryptophan to satisfy nutritional requirement in human diet”
b) "Molecular Genetics and Biophysical Studies on Reaction
Center Protein from Rhodopseudomonas viridis".
4.4. 1993-1994: National Research Council (CNPQ)
- National Computer Research Network (RNP)
and CENARGEN/EMBRAPA Brasilia, DF, Brazil
4.4.1. Department of Molecular Biology, Laboratory for
Protein Engineering and Bioinfomatics
4.4.2. Position: Group Leader and Chief Coordinator
4.4.3. Project:
a) Protein modeling
b) Establishment and coordination on the national level
of the Brazilian Molecular Biology and Biotechnology Network (BMBBNet) and
its principal node Brazilian Bioinformatics Resource Center (BBRC).
4.5. 1994 -1996 CENARGEN/EMBRAPA
- Brasília, DF, Brazil
4.5.1. Department of Molecular Biology, Laboratory for
Protein Engineering and Department of Bioinformatics
4.5.2. Position: Researcher/level III; Group Leader and
Chief Coordinator
4.5.3. Project:
a) Protein modeling, DNA/Protein interaction studies
b) Coordination on the national level of the Brazilian
Molecular Biology and Biotechnology Network (BMBBNet) and its principal
node Brazilian Bioinformatics Resource Center (BBRC).
4.6. 1997-1998 : Columbia University, New York, USA -Barry Honig's Lab
4.7. 1998 -2000 CENARGEN/EMBRAPA
- Brasília, DF, Brazil
4.7.1. Bioinformatics Laboratory
4.7.2. Position: Researcher/level III; Group Leader
4.8. 2000 - - Embrapa
Informática Agropecuária (CNPTIA) - Campinas, SP, Brazil
4.8.1 Computational Biology Research Group (GPBC)
4.8.2 Group Leader
5.1. INACTIVE Associação
Brasileira da Bioinformatica e Biologia Computacional (AB3C)
- Brazil.
5.2. ACTIVE
Sociedade Brasileira da Bioquímica e Biologia Molecular (SBBq)
- Brazil.
5.3. INACTIVE Biophysical
Society, USA.
5.4. INACTIVE Biophysical
Society, Yugoslavia.
5.5. INACTIVE Protein
Society - International
5.6. ACTIVE
International Society for Computational
Biology (ISCB) - Member
of the ISCB Board of Directors (2002-2005)
ACTIVE
6.1. Serbian, English, Russian and Portuguese (conversation,
reading and writing competence).
6.2. Spanish and Italian (reading competence)
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Goran Neshich
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Total # of papers |
53
|
46
|
147
|
Total # of citations |
437
|
564
|
944
(359 - since 2013) |
Total citations per Item: |
11.81
|
12.27
|
6,42
|
H - Factor (index) |
14
|
16
|
20(11 since 2013)
|
i10-index: |
30(16 since 2013)
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Keyword serched: |
(Neshich G OR Nesic G OR Neschich G)
|
(Neshich G OR Nesic G OR Neschich G)
|
(Neshich G OR Nesic G OR Neschich G)
|
Updated |
July 12, 2018
|
July 12, 2018
|
July 12, 2018
|
7.1.
Goran Neshich, Milan Schara, Marijeta Sentjurc,
Zeljko Vucinic:
"An EPR study of temperature dependent
changes in fluidity of isolated maize thylakoid."
Periodicum Biologorum, Vol.84, Nº2. 166-169, 1982, Zagreb, Yugoslavia.
DOI:
7.2.
Zeljko Vucinic, Goran Neshich and Cedomir Radenovic:
"Delayed fluorescence as an in situ probe
of fluidity changes in maize photosynthetic membranes."
Periodicum Biologorum, Vol. 84, Nº 2. 221-226, 1982, Zagreb, Yugoslavia.
DOI:
7.3.
I.C. Bezerra, L.A.B. de Castro, G. Neshich and
D.C. Monte- Neshich:
"A corm-specific gene encodes tarin, a
major globulin of taro (Colacasia esculenta L. Schott)."
Plant Molecular Biology, 28: 137-144, 1995.
DOI: 10.1007/BF00042045
7.4.
P.G.B. Carvalho, C. Bloch Jr., L. Morhy, Maria C.M. da Silva, Luciane V.
de Mello, and Goran Neshich:
"Amino Acid Sequence of the Phaseolus
vulgaris Var. "Fogo na serra" Inhibitor and Interactive Surface Modeling
for the enzyme-Inhibitor Complex."
Journal of Protein Chemistry, Vol. 15, Nº 6, 1996, 591-598.
DOI:
7.5.
L.H. Marcellino, G. Neshich, M.F. Grossi de Sa,
E. Krebbers and E. Gander:
“Modified 2S Albumins with improved tryptophan
content are correctly expressed in transgenic tobacco plants.”
FEBS Letters 385 (1996) 154-158.
DOI: https://doi.org/10.1016/0014-5793(96)00375-4
7.6.
M. Vincentz, . Leite, L. Barros, D. Weinberg, E. de Almeida, M. Paes de
Carvalho, F. Aragão, E. Gander and G. Neshich:
“ACGT and Vicilin core sequences in a
promoter domain required for seed specific expression of a 2S storage protein
gene are recognized by the Opaque-2 regulatory protein."
Plant Molecular Biology vol. 34, 1997 879-889.
DOI: 10.1023/A:1005874404706
7.7.
S.M. de Freitas, L.V. de Mello, M.C.M. da Silva, G. Vriend,G.
Neshich and M.M. Ventura:
“Analysis of the Black-eyed Pea Trypsin
and Chymotrypsin Inhibitor-alpha-chymotrypsin complex."
FEBS Letters 409 (1997) 121-127.
DOI: http://onlinelibrary.wiley.com/doi/10.1016/S0014-5793(97)00419-5/full
7.8.
T.B. Cavalcante, A Rezende, R. Togawa, Patricia Rodrigues, Luciano Magalhaes
and G. Neshich:
"A new field-tested electronic system
for data gathering, recording, transfer and dissemination via the World
Wide Web."
Taxon 47, May (1998), 381-386.
DOI:
7.9.
G. Neshich, Roberto Togawa and Barry Honig:
"Sequence To and withIN Graphics PDB Viewer
(STING -PDB viewer)."
PDB Quarterly NewsLetter, July 1998, page 6.
DOI:
7.10.
G. Neshich, Roberto Togawa, Jaime Prilusky, Joel
Suussman and Barry Honig:
"Searching for the Right PDB File with
the 3DB Browser and Displaying Structure and Sequence Data with STING."
DOI:
PDB Quarterly NewsLetter, July 1998, page 7.
7.11.
Da Silva M.C.M., Grossi de Sá M.F., Chrispeels M.J., Togawa R.C. and G.
Neshich:
"Analysis of Structural and Physico-chemical
Parameters Involved in the Specificity of Binding between Alpha-Amylases
and their Inhibitors."
Protein Engineering, Vol. 13, Nº 3, 167-177, March 2000.
DOI: 10.1093/protein/13.3.167
7.12.
Caldas, C.A., Coelho, V.P.C.V., Rigden, D., G. Neshich,
Moro, A.M. and Brigido, M.:
"Design and synthesis of germline-based
hemi-humanized single chain Fv against the CD18 surface antigen."
Protein Engineering Vol. 13, Nº5, 353-360, May 2000.
DOI: 10.1093/protein/13.5.353
7.13.
G. Neshich, Roberto Togawa, Adauto
L. Mancini, Paula R. Kuser, Michel E. B. Yamagishi, Georgios Pappas Jr.,
Wellington V. Torres, Tharsis Fonseca e Campos, Leonardo L. Ferreira, Fabio
M. Luna, Adilton G. Oliveira, Ronald T. Miura, Marcus K. Inoue, Luiz G.
Horita, Dimas F. de Souza, Fabiana Dominiquini, Alexandre Álvaro, Cleber
S. Lima, Fabio O. Ogawa, Gabriel B. Gomes, Juliana C. F. Palandrani, Gabriela
F. dos Santos, Esther M. de Freitas, Amanda R. Mattiuz, Ivan C. Costa, Celso
L. de Almeida, Savio Souza, Christian Baudet and Roberto H. Higa:
"STING Millennium: a Web based suite of programs for comprehensive and simultaneous
analysis of protein structure and sequence."
Nucleic Acids Research Vol. 31, Nº 13, page 3386 - 3392, 2003.
DOI: 10.1093/nar/gkg578
7.14.
Fernandez J. H., Hayashi M.A.F., Camargo A.C.M. 1 and G.
Neshich:
"Structural basis of the lisinopril binding
specificity in N and C domains of human somatic ACE."
BBRC: Biochemical and Biophysical Research Communications 308 (2003)219-226.
DOI: 10.1016/S0006-291X(03)01363-9
7.15.
Paula Kuser Falcão, Michel Yamagishi, Roberto Higa e Goran
Neshich:
"Sting Millennium Suite: ferramentas para
análise estrutural de proteínas."
DOI:
Com Ciência, August, 2003.
7.16.
R. C. Togawa, P. R. Kuser, R. H. Higa, M. E. B. Yamagishi, A. L. Mancini,
and G. Neshich*:
"STING Millennium Suite: integrated software
for extensive analyses of 3d structures of proteins and their complexes."
BMC Bioinformatics. 2004 Aug 09;5(1):107.
DOI: 10.1186/1471-2105-5-107
7.17.
R.H. Higa, A.G. Oliveira1, L.G. Horita1, R.T. Miura1, M.K. Inoue1 P.R. Kuser,
A.L. Mancini, M.E.B. Yamagishi, R. Togawa1, and G.
Neshich*:
"Defining 3D residue environment in protein structures using SCORPION and
FORMIGA."
Bioinformatics. 2004 Aug 12;20(12):1989-1991. Epub 2004 Mar 25.
DOI: 10.1093/bioinformatics/bth190
7.18.
R. H. Higa, R. C. Togawa2, P. R. Kuser, M. E. B. Yamagishi, A. L. Mancini,
G. Pappas Jr.3, R. T. Miura2, L. G. Horita2, and G.
Neshich*: "ConSSeq: a web-based
application for analysis of amino acid conservation based on HSSP database
and within context of structure."
Bioinformatics. 2004 Aug 12;20(12):1983-5. Epub 2004 Mar 25.
DOI: 10.1093/bioinformatics/bth185
7.19.
R. C. Togawa2, P. R. Kuser, R. H. Higa, M. E. B. Yamagishi, A. L. Mancini,
and G. Neshich*:
"STING Contacts: a web-based application
for identification and analysis of amino acid contacts within protein structure
and across protein interfaces."
Bioinformatics. 2004 Sep 1;20(13):2145-7.
Epub 2004 Apr 08.
DOI: 10.1093/bioinformatics/bth203
7.20.
Goran Neshich, Walter Rocchia, Adauto L. Mancini,
Michel E. B. Yamagishi, Paula R. Kuser, Renato Fileto, Christian Baudet,
Ivan P. Pinto, Arnaldo J. Montagner, Juliana F. Palandrani, Joao N. Krauchenco,
Renato C. Torres, Savio Souza, Roberto C. Togawa and Roberto H. Higa:
"JavaProtein Dossier: a novel web-based data visualization tool for comprehensive
analysis of protein structure."
Nucleic Acids Res. 2004 Jul 1;32(Web Server issue):W595-601.
DOI:: 10.1093/nar/gkh480
7.21.
Marcellino LH, Neshich
G, Neto AF, Gander ES.:
"An opaque-2-like transcription factor from pearl millet."
Protein Pept Lett. 2004 Aug;11(4):345-52.
DOI: http://dx.doi.org/10.2174/0929866043407002
7.22.
SILVA, Maria Cristina Mattar da; MELLO, Luciane V de; COUTINHO, Marise Ventura;
RIGDEN, Daniel John; Goran Neshich; CHRISPEELS,
Maarten John; GROSSI DE SA, Maria Fatima:
"Mutants of common bean alpha-amylase inhibitor-2 as an
approach to investigate binding specificity to alpha-amylases."
Pesquisa Agropecuária Brasileira, Brazil, v. 39, n. 3, p. 201-208, 2004.
DOI: http://dx.doi.org/10.1590/S0100-204X2004000300001
7.23.
Goran Neshich, Adauto L. Mancini, Michel E.
B. Yamagishi, Paula R. Kuser, Renato Fileto, Ivan P. Pinto, Juliana F. Palandrani,
João N. Krauchenco, Christian Baudet, Arnaldo J. Montagner and Roberto H.
Higa:
" STING Report: convenient web-based application for graphic
and tabular presentations of protein sequence, structure and function descriptors
from the STING database."
Nucleic Acids Res. 2005
Jan 1;33 (Database Issue):D269-74.
DOI: 10.1093/nar/gki111
7.24.
NESHICH, Goran; BORRO, Luiz C; HIGA,
Roberto; KUSER, Paula; YAMAGISHI, Michel; FRANCO, Eduardo H; KRAUCHENCO,
Joao; FILETO, Renato; RIBEIRO, Andre; BEZERRA, George; VELLUDO, Thiago;
JIMENEZ, Tomas; FURUKAWA, Noburo; TESHIMA, Hirofumi; KITAJIMA, Koji; BAVA,
Abdulla; SARAI, Akinori; TOGAWA, Roberto; MANCINI, Adauto:
" Diamond STING Server."
Nucleic Acids Res. 2005 Jul 1;33(Web Server issue):W29-35.
DOI: 10.1093/nar/gki397
7.25.
HERNANDEZ, Jorge Fernandez; NESHICH, Goran;
ACM, Camargo:
"USING BRADYKININ POTENTIATING PEPTIDE (BPP) STRUCTURES
TO DEVELOP NEW ANTIHIPERTENSIVE DRUGS."
Genet. Mol. Res, Riberao Preto, v. 3, n. 4, p. 554-563, 2005.
DOI:
7.26.
Yamagishi ME, Martins NF, Neshich G, Cai W,
Shao X, Beautrait A, Maigret B.:
"A fast surface matching procedure for protein-ligand docking."
J Mol Model (Online). 2006 May 4.
DOI: 10.1007/s00894-006-0109-z
7.27.
HIGA, Roberto; KUSER, Paula; MICHEL, Yamagishi; MANCINI, Adauto; NESHICH,
Goran:
" Building Multiple Sequence Alignments with a flavor of HSSP alignments."
Genet. Mol. Res. 5 (1), p: 127-137, 2006.
DOI:
7.28.
Luiz C. Borro, Stanley R.M. Oliveira, Michel E.B. Yamagishi, Adaulto L.
Mancini, José G. Jardine, Ivan Mazoni, Edgard H. dos Santos, Roberto H.
Higa, Paula R. Kuser and Goran Neshich:
"Predicting enzyme class from protein structure using Bayesian classification."
Genet. Mol. Res. 5 (1), p:193-202, 2006.
DOI:
This article was cited:[ISI:
17] [Google Scholar: 34]
[Scopus:12]
7.29.
Renato Fileto, Paula R. Kuser, Michel E. B. Yamagishi, André A. Ribeiro,
Thiago G. Quinalia, Eduardo H. Franco, Adauto L. Mancini, Roberto H. Higa,
Stanley R. M. Oliveira, Edgard H. Santos, Fabio D. Vieira, Ivan Mazoni,
Sergio A. B. Cruz, Goran Neshich:
"PDB-metrics: a web tool for exploring the PDB contents."
Genet. Mol. Res. 5 (2),
p:333-341, 2006.
DOI:
7.30.
Goran Neshich, Ivan Mazoni, Stanley R. M. Oliveira,
Michel E. B. Yamagishi, Paula R. Kuser-Falcão, Luiz C. Borro, Douglas U.
Morita, Kassyus R. R. Souza, Gustavo V. Almeida, Diego N. Rodrigues, José
G. Jardine, Roberto C. Togawa, Adauto L. Mancini, Roberto H. Higa, Sérgio
A. B. Cruz, Fábio D. Vieira, Edgard H. dos Santos, Raquel C. de Melo and
Marcelo M. Santoro:
"The Star STING server:
A multiplatform environment for protein structure analysis."
Genet. Mol. Res. 5 (4), 717-722, 2006.
DOI:
7.31.
NESHICH, G, Bourne
PE, Brunak, S.:
" ISMB 2006."
PLoS Comput Biol. Feb;2(2), 2006.
doi:10.1371/journal.pcbi.0020011
7.32.
M.C. Simões; D. Bahia; A.Z. Neto; K. Torres; F. Artiguenave; G.
Neshich; P.R. Kuser, G.C. Oliveira:
"Single nucleotide polymorphisms identification in expressed genes of
Schistosoma mansoni."
Molecular and Biochemical Parasitology, 154 134-140, 2007.
DOI:10.1016/j.molbiopara.2007.04.003
7.33.
Jorge H. Fernandez, Marcia O. Mello, Leticia Galgaro, Aparecida S. Tanaka,
Marcio C. Silva-Filho, Goran Neshich:
"PROTEINASE INHIBITION USING SMALL BOWMAN-BIRK
TYPE STRUCTURES."
Genet. Mol. Res. 6 (4): 846-858
(2007)
DOI:
7.34.
R.C. Melo, C. Ribeiro, C.S. Murray, C.J.M. Veloso, C.H.. da Silveira, Goran
Neshich, W. Meira Jr, R.L. Carceroni and M.M. Santoro:
"Finding protein-protein interactions by contact-maps matching."
Genet. Mol. Res. 6 (4): 946-963 (2007)
DOI:
7.35.
Walter Rocchia and Goran
Neshich:
"Electrostatic Potential Calculation for biomolecules - creating a database
of pre-calculated values reported on a per residue basis for all PDB protein
structures."
Genet. Mol. Res. 6 (4):
923-936 (2007)
DOI:
7.36 .
Stanley R. M. Oliveira, Gustavo V. Almeida, Kassyus
R. R. Souza, Diego N. Rodrigues, Paula R. Kuser-Falcão, Michel E. B.Yamagishi,
Edgard H. Santos, Fábio D. Vieira, José G. Jardine and
Goran Neshich:
"STING_RDB: A relational database of structural parameters
for protein analysis with support for Data Warehousing and Data Mining."
Genet. Mol. Res. 6 (4): 911-922 (2007)
DOI:
7.37.
NESHICH, G:
"Computational Biology in Brazil."
PLoS Comput Biol. Oct; v3 (issue 10, e185), 2007.
DOI:10.1371/journal.pcbi.0030185
7.38.
MOUTRAN, Alexandre; BALAN, Andrea; PEREZ, Carolina Santacruz; FERREIRA,
Rita Café;
RAMOS, Carlos; FERREIRA, Luís Carlos Souza; NESHICH,
Goran:
"Crystallographic structure and substrate-binding interactions of
the 3 molybdate-binding protein of the phytopathogen 4
Xanthomonas axonopodis pv. citri.”
Biochim Biophys Acta. 2008 Feb;1784(2):393-9.
DOI:10.1016/j.bbapap.2007.11.013
7.39.
R. C. Togawa, C. Ribeiro, I. Mazoni, T. Pelligrinelli, and NESHICH,
Goran:
" The Table of Interface Forming Residues as the Specificity Indicator
for Serine Proteases Bound to Different Inhibitors "
BIOCOMP 08, 2008.
DOI:
7.40.
Carlos H. da Silveira, Douglas E. V. Pires , Raquel C. Melo , Cristina Ribeiro
, Caio J. M. Veloso ,
Julio C. D. Lopes , Wagner Meira Jr , Goran Neshich
, Carlos H. I. Ramos , Raul Habesch, Marcelo M. Santoro
"Protein cutoff scanning: A comparative analysis of cutoff dependent
and cutoff free methods for prospecting contacts in proteins."
PROTEINS: Structure, Function, and Bioinformatics, Proteins
2009; 74:727–743
DOI: 10.1002/prot.22187
7.41.
Janaína Gomide, Raquel Melo-Minardi, Marcos Augusto dos Santos, Goran
Neshich,
Wagner Meira Jr., Júlio César Lopes and Marcelo Santoro
"Using linear algebra for protein structural comparison and classification"
Genetics and Molecular Biology, 32, 3, 645-651 (2009)
DOI: http://dx.doi.org/10.1590/S1415-47572009000300032
7.42.
Cristina Ribeiro, Roberto C Togawa, Izabella AP Neshich, Ivan Mazoni, Adauto
L Mancini,
Raquel C de Melo Minardi, Carlos H da Silveira, José G Jardine, Marcelo
M Santoro, Goran Neshich
"Analysis of binding properties and specificity through identification
of the interface forming residues (IFR) for serine proteases in silico docked
to different inhibitors"
BMC Structural Biology 2010, 10:36
DOI:10.1186/1472-6807-10-36
7.43.
Francisco Duarte, Rene Sepulveda, Raul Araya, Sebastian Flores, Tomas Perez-Acle,
Wnedy Gonzales, Danilo Gonzales, Goran Neshich, Izabella
Neshich, Ivan Mazoni, David Holmes
"Mechanisms of protein stabilization at very low pH"
Biohydrometallurgy: Biotech key to unlock mineral resources value, Proceedings
of the 19th International Biohydrometallurgy Symposium, September 18-22,
2011.
DOI:
7.44.
Carolina Ayumi Braghini, Izabella Agostinho Pena Neshich, Goran
Neshich , Fernanda Caroline Soardi , Maricilda Palandi de Mello,
Vital Paulino Costa,
José Paulo Cabral de Vasconcellos, Mônica Barbosa de Melo
"New mutation in the myocilin gene segregates with juvenile-onset
open-angle glaucoma in a Brazilian family".
Gene 523, 50-57, 2013.
This
article was cited:[ISI:
1]
[Google Scholar: 5]
DOI:10.1186/1472-6807-10-36
7.45.
Camila Dias-Lopes, Izabella A. P. Neshich, Goran Neshich,
José Miguel Ortega, Claude Granier, Carlos Chávez-Olortegui,
Franck Molina, Liza Felicori
"Identification of New Sphingomyelinases D in Pathogenic Fungi and
Other Pathogenic Organisms".
PlosOne, DOI:10.371/journal.pone.0079240, Vol. 8, Issue 11, 2013.
This
artic le was cited:[ISI:0]
[Google Scholar: 3]
DOI: 10.1371/journal.pone.0079240
7.46.
MORAES, F. R. ; NESHICH, I. A. P. ; MAZONI, Ivan ; YANO, I. H. ; PEREIRA,
J. G. C. ; SALIM, J. A. ; JARDINE, José G. ;
Goran Neshich.
"Improving predictions of protein-protein interfaces by combining
amino acid-specific classifiers based on structural and physicochemical
descriptors with their weighted neighbor averages".
Plos One,
Published: January 28, 2014, Volume 9, Issue 1, e87107
DOI: 10.1371/journal.pone.0087107
7.47.
Goran
Neshich, Izabella Agostinho Pena Neshich, Fabio Moraes, Jose
Augusto Salim, Luiz Borro, Inacio Henrique Yano, Ivan Mazoni, Jose Gilberto
Jardine and Walter Rocchia
"Using Structural and Physical–Chemical Parameters to Identify,
Classify, and Predict Functional Districts in Proteins—The Role of Electrostatic
Potential".
BOOK CHAPTER: in - Computational Electrostatics for Biological Applications
Editors: Walter Rocchia, Michela Spagnuolo
Publisher: Springer International Publishing, pp 227-254,
DOI: 10.1007/978-3-319-12211-3_12
Print ISBN: 978-3-319-12210-6
Online ISBN: 978-3-319-12211-3
Published: November 30, 2014,
7.48.
José Gilberto Jardine, Izabella Agostinho Pena Neshich, Ivan Mazoni,
Inácio Henrique Yano, Fábio Rogério de Moraes, Jose
Augusto Salim, Luiz Borro, Letícia Sayuri Nishimura,
Goran Neshich.
"Biologia computacional molecular e suas aplicações
na agricultura".
In "Tecnologia da informação e comunicação
e suas relações com a agricultura"
Pages: 101-118
PROCISUR,
Published: November 28, 2014,
7.49.
Ricardo Andrez Machado-de-Ávilaa, Mariana Vellosob, Daysiane Oliveirab,
Stephanie Stranskyb, Ana Flor-Sáb, Francisco S. Schneiderb,Goran
Neshich, Carlos Chávez-Olórtegui.
"Induction of neutralizing antibodies against mutalysin-II from
Lachesis muta muta snake venom elicited by a conformational B-cell epitope
predicted by Blue Star Sting Data Base".
Immunome Research --Volume: 11 Issue: 1 Pages: 1-6 Published: 2015
doi: 10.4172/1745-7580.1000083
7.50.
Izabella Agostinho Pena Neshich, Leticia Nishimura, Fabio Rogério
de Moraes, Jose Augusto Salim, Fabian Villalta-Romero, Luiz Borro, Inacio
Henrique Yano, Ivan Mazoni, Ljubica Tasic, Jose Gilberto Jardine and
Goran Neshich.
"Computational Biology tools for identifying specific targets for
novel agrochemical and drug design".
Current Protein and Peptide Research --Volume: 16 Issue: 8 Pages: 1-17 Published:
2015
DOI: https://doi.org/10.2174/1389203716666150505234923
7.51.
Joana D’Arc Campeiro, Izabella P. Neshich, Osvaldo
A. Sant’Anna, Robson Lopes, Danielle Ianzerd, Marina T. Assakura, Goran
Neshich and Mirian A.F. Hayashi
"Identification of snake bradykinin-potentiating peptides (BPPs)-simile
sequences in rat brain – Potential BPP-like precursor protein?".
Biochemical Pharmacology --Volume: 16 Issue: 8 Pages: 212-266 Published:
2015
DOI:10.1016/j.bcp.2015.05.012
7.52.
SALIM, J. A. ; BORRO, Luiz ; MAZONI, Ivan ; YANO, I. H. ; JARDINE, José
G. ; Goran Neshich
"Multiple Structures Single Parameter (MSSP): a tool for graphical
analysis of a single parameter describing a shared loci on structurally
aligned proteins".
OUP Bioinformatics; 2016
DOI: 10.1093/bioinformatics/btw082
7.53.
VIART, B. ; E., G. ; NESHICH, G ;
CHÁVEZ-OLORTEGUI, CARLOS ; MOLINA, F. ; FELICORI, L. .
" EPI-Peptide Designer : a tool to Peptide ligand's targeted library
design based on Epitope-Paratope Interactions",
BMC Bioinformatics, Published: 2016
DOI: 10.1093/bioinformatics/btw014
7.54.
Fabian Villalta-Romero, Luiz Borro, Boris Mandica, Teresa Escalante,
Alexandra Rucavado, Jose María Gutiérrez, Goran
Neshich and Ljubica Tasic
" Discovery of small molecule inhibitors for the snake venom metalloprotease
BaP1 using in silico and in vitro tests",
Bioorganic & Medicinal Chemistry Letters, Published: 2017
DOI: https://doi.org/10.1016/j.bmcl.2017.03.007
7.55.
Roney Vander dos Santos. Fabian Villalta-Romero, Luiz Borro, Danijela
Stanisic, Goran Neshich and Ljubica
Tasic
" Citrus bioflavonoid, hesperetin, as inhibitor of two thrombin-like
snake venom serine proteases isolated from Crotalus simus",
Toxicon, 143, March 2018, Pages 36-43
DOI: https://doi.org/10.1016/j.toxicon.2018.01.005
7.56.
Ivan Mazoni, Luiz César Borro, José Gilberto Jardine,
Inácio Henrique Yano, José Augusto Salim and Goran
Neshich
" Study of specific nanoenvironments containing a-helices in all-a
and (a+ß)+(a/ß) proteins",
Plos One, July 10, 2018, Pages 1-25
DOI:
https://doi.org/10.1371/journal.pone.0200018
7A. PUBLICATIONS Accepted
This Section Updated: February 08,
2017
7B. PUBLICATIONS Submitted
This Section Updated: July 12, 2016
7.57.
Manoel V. F. Barrionuevo, Luiz C. Borro, Camilla Abbehausen and Goran
Neshich
" Structural and sequence wise analysis of B1 and B3 metallo-b-lactamases
suggesting a set of shared structural and physicochemical
properties: a road for a selective inhibitor", Bioorganic &
Medicinal Chemistry Letters, To be Published: 2017
7.58.
Luiz Borro, Ivan Mazoni, Inacio Yano and Goran
Neshich
" Protein Specificity Analysis by STING - PsaS",
OUP Bioinformatics, To be Published: 2017
7.59.
Luiz Borro, Ivan Mazoni, Inacio Yano and Goran
Neshich
" Ranking optimization of small organic compounds in virtual screening
campaigns using physical-chemical and structural descriptors of the protein-ligand
interaction nano-environment ",
OUP Bioinformatics, To be Published: 2017
7.60.
Jose Augusto Salim, Ivan Mazoni, Luiz Borro, Inacio Yano and Goran
Neshich
" STING Descriptor Library: atructural and physico chemical parameter
calculation, analysis and Relational Databas".
OUP Bioinformatics, To be Published: 2017
8.1.
Z. Vucinic, G. Neshich, C. Radenovic: "Influence
of temperature at photosynthetic process: Photo-induced bioluminescence
as an in situ method to monitor fluidity changes of the thylakoid membranes".
XI Yugoslav Biophysics Symposium, pp 101, Donji Milanovac, 11-14 October,
1981, Yugoslavia.
8.2.
G. Neshich, M. Schara, M. Sentjurc, Z. Vucinic:
"Studies on conformational changes in thylakoid membranes of the chloroplasts
from different maize genotypes using EPR spectroscopy". XI Yugoslav
Biophysics Symposium, pp 102, Donji Milanovac, 11-14 October, 1981,
Yugoslavia.
8.3.
Z. Vucinic, G. Neshich, C. Radenovic: "Photoinduced
bioluminescence as in situ method for monitoring state of fluidity in thylakoid
membranes". - Book of abstracts, problems in biophysics, SEP meeting,
1982, pp. III-33, Puschino, USSR.
8.4 .
Z. Vucinic, G.Neshich: "Possible application
of the fluorescence methods for photosynthesis research in maize breeding
program". - Second seminar of Yugoslav Society for plant physiology,
Serbian Academy of Science, SANU, in Belgrade, March 27-29. 1983,
Yugoslavia.
8.5.
Z. Vucinic, G. Neshich, J. Svetek, M.
Schara: "Proline effects on maize thylakoid membrane fluidity and water
structure ordering". - Book of abstracts of XII Yugoslav biophysics
symposium, p. 51, Sept. 29 - Oct. 01. 1983. Opatija, Yugoslavia.
8.6.
G. Neshich, D. DeVault and C. Wraight:
"Kinetics of Electron Transfer from high potential Cytochrome c hemes
to P+ functionally associated to photochemical reaction center
in Rhodopseudomonas viridis" - Biophysical Society meeting, Cincinnati,
OH, USA, February.05-12. 1989.
8.7.
F.X.S. Scares, M.C.M. da Silva, T.L. Rocha, L.H. Marcellino, N.S. Paes,
I. Caracelli, M. Carneiro, E. Gander, M-J.A.M. Sampaio, L-A.B. De Castro
and G. Neshich: "Theoretical model of
the secondary and tertiary structure of Brazil nut 2s storage albumins"
in Abstracts of the First International Symposium on Crystallography and
Molecular Biology, November 1990, Guaruja, SP, Brazil.
8.8.
L.H.Marcellino, M.C.M. da Silva, T.L. Rocha, N.S. Paes, M. Carneiro,
E. Gander, M-J.A.M. Sampaio, L-A.B. De Castro and G.
Neshich: "Introduction of tryptophan in the brazil nut 2s storage
albumins by site- directed mutagenesis" in Abstracts of the First International
Symposium on Crystallography and Molecular Biology, November 1990,
Guaruja, SP, Brazil.
8.9.
M.C.M. da Silva, T.L. Rocha, L.H. Marcellino, N.S. Paes, I. Caracelli,
M. Carneiro, E. Gander, M-J.A.M. Sampaio, LA.B. De Castro and G.
Neshich: "Brazil nut 2s storage albumin isoform purification and
circular dichroism assisted secondary structure confirmation" in Abstracts
of the First International Symposium on Crystallography and Molecular
Biology, November 1990, Guaruja, SP, Brazil.
8.10.
M.C.M. da Silva, L.V. de Mello, C. Bloch Jr., L. Morhy and G.
Neshich: "Disulphide bridges determination in a 2S albumin storage
protein from Brazil nut (Bertholetia excelsa H.B.K.) Preliminary studies".
In "Resumos da XXI Reunião Anual da Sociedade Brasileira de bioquímica e
biologia molecular” Caxambu, MG, Brazil 16-19 May, 1992.
8.11.
I.C. Bezerra, L.A.B. De Castro, G. Neshich,
E.R. Almeida and D.C. Monte-Neshich: "Structure of the gene coding for
a major protein from taro tuber (Colocasia esculents)". In "Programa
e Resumos da XXII Reunião Anual da Sociedade Brasileira de bioquímica e
biologia molecular" Caxambu, MG, Brazil 1-4 May, 1993.
8.12.
P.G.B. Carvalho, C. Bloch Jr. and L. Morhy in collaboration with
G. Neshich: "The complete amino-acid sequence
of a Bowman-Birk inhibitor from seeds of Phaseolus vulgaris Var. "Fogo
na serra"." In "Programa e Resumos da XXII Reunião Anual da Sociedade
Brasileira de bioquímica e biologia molecular" Caxambu, MG, Brazil
1-4 May, 1993.
8.13.
M.C.M. da Silva, L.V. de Mello, C. Bloch Jr., L Morhy, J.B. Aragão
and G. Neshich: "Determination of the disulphide
bridges in 2S albumin from Brazil nut (Bertholetia excelsa H.B.K.) ".
In "Programa e Resumos da XXII Reunião Anual da Sociedade Brasileira de
bioquimica e biologia molecular” Caxambu, MG, Brazil 1-4 May,
1993.
8.14.
L.H.Marcellino, E. Gander, A.S. Conceicao, E. Krebers and G.
Neshich: "Introduction of tryptophan in the brazil nut 2s protein".
In "Programa e Resumos da XXII Reuniao Anual da Sociedade Brasileira de
bioquimica e biologia molecular" Caxambu, MG, Brazil 1-4 May, 1993.
8.15.
S.M.Freitas, L.V.Mello, M.C.M.Silva, M.M.Ventura and
G.Neshich: "The Binding Surface Identification Through The Homology
Modeling For The System Black Eyed Pea Trypsin And Chymotrypsin Inhibitor
(BTCI)/Chymotrypsin". Caxambu, MG, Brazil, May 14-17, 1994.
8.16.
P.G.B.Carvalho, C.Bloch Jr. L.V.Mello, M.C.M. Silva,
G.Neshich : "Calculation of Electrostatic Potential Around The
Active Site Region For The System: Bowman-Birk Inhibitor From Seeds of Phaseolus
vulgares Var. “Fogo na Serra” (PFSI) /Chymotrypsin". Caxambu, MG, Brazil,
May 14-17, 1994.
8.17.
E. Gander, M. Vicentz, A. Leite, M.C. Mattar de Silva, G. Vriend,
L. Barros, D. Weinberg, E. R. de Almeida, M. Pais de Carvalho, F. Aragão
and. G. Neshich: "The opaque-2 regulatory
protein recognizes acgt and vicilin core sequences in an essential seed
specific promoter region from a brazil nut albumin gen." The Protein Society
- Ninth Symposium, Boston, MA - USA, July 8-12, 1995.
PROGRAM & ABSTRACTS: 180 (672-M)
8.18.
T.B. Cavalcante, A Rezende, R. Togawa and G. Neshich:
" Field data collection, relational data-base data formating, printing
of the data on the self-adhesive labels and data distribution through World
Wide Web". XLVII Congresso Nacional de Botanica, Nova Friburgo/RJ,
Brazil, 21-26 de Julho de 1996.
8.19.
M.C. Mattar da Silva, G. Neshich, R.
Togawa, M.Crispeels and M. F. Grossi de Sa: "Molecular Modeling of Plant
alpha-amylase inhibitors and insect alpha-amylases complexes". III Encontro
Latino Americano De Biotecnologia Vegetal, La Havana, Cuba,
June 1-5, 1998
8.20.
Da Silva MCM, G. Neshich, Ghrispeels
M., Roberto Togawa and Grossi de Sa, M.F:"Molecular Basis of the Interactions
Between Insect Alpha-Amylases and Inhibitors". XXVIII Reuniao
Anual da Sociedade Brasileira de Bioquimica e Biologia Molecular - SBBq
- Caxambu, MG, Brazil,May 22-25, 1999.
8.21.
Fonseca, A.S., G. Neshich, Brigido M.M.:
"Design and Construction of a Humanized Version for the Ant-CD2 Fv through
a New Strategy." XXVIII Reuniao Anual da Sociedade Brasileira de Bioquimica
e Biologia Molecular - SBBq - Caxambu, MG, Brazil, May 22-25, 1999.
8.22.
Goran Neshich, Roberto C. Togawa, Wellington
Vilella Torres, Tharsis Fonseca e Campos, Leonardo Lima Ferreira, Adilton
Guedes Oliveira, Ronald Tetsuo Miura, Marcus Kiyoshi Inoue, Luiz Gustavo
Horita, Georgios Pappas Jr.,Barry Honig: "STING Millennium: Web based
suite of programs for comprehensive and simultaneous analysis of structure
and sequence", ISMB 2001, Denmark, abstract#87
2003
8.23.
Adauto L. Mancini, Roberto H. Higa, Paula R. Kuser, Michel E. B. Yamagishi
and Goran Neshich "STING MILLENNIUM SUITE
(SMS): a Web tool for identification and visualization of protein intra
and inter chain contacts", Resumo número: 301595. XXXII Reuniao Anual
da Sociedade Brasileira de Bioquimica e Biologia Molecular - SBBq - Caxambu,
MG, Brazil, May 17-20, 2003.
8.24.
Michel E. B. Yamagishi, Adauto Mancini, Roberto H. Higa, Paula R. Kuser
and Goran Neshich "In Silico Filtering of
Successful Protein-Ligand Binding", Resumo numero: 300345. XXXII Reuniao
Anual da Sociedade Brasileira de Bioquimica e Biologia Molecular - SBBq
- Caxambu, MG, Brazil, May 17-20, 2003.
8.25.
Roberto H. Higa, Christian Baudet, Paula R. Kuser, Adauto L. Mancini, Michel
E. B. Yamagishi and Goran Neshich "Java
Protein Dossier – a java tool for analyzing stability and potential function
of proteins with known structure", Resumo número: 300592. XXXII Reuniao
Anual da Sociedade Brasileira de Bioquimica e Biologia Molecular - SBBq
- Caxambu, MG, Brazil, May 17-20, 2003.
8.26.
Paula R. Kuser, Roberto H. Higa, Christian Baudet, Adauto L. Mancini, Michel
E. B. Yamagishi and Goran Neshich "STING
MILLENNIUM - Suite of software tools for analysis of protein structures
and summary of structure/function parameters", Resumo número: 300538.
XXXII Reuniao Anual da Sociedade Brasileira de Bioquimica e Biologia Molecular
- SBBq - Caxambu, MG, Brazil, May 17-20, 2003.
8.27.
Goran Neshich, Roberto Togawa, Walter Rocchia, Adauto L. Mancini,
Paula R. Kuser, Michel E. B. Yamagishi, Alexandre 301lvaro, Christian Baudet
and Roberto H. Higa "STING MILLENNIUM SUITE v.3 and JAVA PROTEIN DOSSIER:
a novel concept in data visualization and analysis of the protein structure/function
relationship" has been accepted for presentation at ISMB2003, Brisbane,
Australia, 29th June - 3rd July, 2003.
8.28.
Guelfi, A., Molina, S. M. G., Neshich, G. "Structural
alignment: A clue for enzyme function?", 49º Congresso Nacional de Genética
- SBG - Águas de Lindóia, SP, Brazil, September 16 - 19, 2003.
8.29.
Hernandez, J.F.1, Hayashi, M.A.F.2, Neshich,
G.1, and Camargo, A.C.M.2 " “in silico” model for human sACE substrate
binding : structural parameters defining N- and C-domain substrate specificity",
I São Paulo Research Conference : Molecular Medicine. Sao Paulo, Brazil,
2003.
8.30.
Neshich, G. GRID Computing at EMBRAPA: "Searching
for the best shape match between the potential drug targets at the protein
surfaces and small chemicals"In: Workshop de Grade Computacional e Aplicações,
LNCC, 2003. v.1. p.97 - 102, Petrópolis, RJ, Brazil, 2003.
8.31.
Hernandez, J.F.1, Hayashi, M.A.F.2, Neshich,
G.1, and Camargo, A.C.M.2 " Comparative Modelling of the N-terminal
Domain of the Human Somatic ACE-Lisinopril Complex" - V Reunião Científica
Anual do Instituto Butantan, Sã Paulo, Brazil, December 01-05, 2003.
8.32.
Neshich, Goran; Fernandez JH; Hayashi
MAF; Camargo ACM “IN SILICO” MODEL FOR HUMAN sACE SUBSTRATE BINDING:
STRUCTURAL PARAMETERS DEFINING N- AND C- DOMAIN SUBSTRATE SPECIFICITY".
In: I SÃO PAULO RESEARCH CONFERENCE : MOLECULAR MEDICINE., 2003, SP. Anais
de I São Paulo Research Conference : Molecular Medicine.. Brazil, 2003.
2004
8.33.
Neshich, Goran; GUELFI, Andrea; G, Molina S M "Structural alignment:
a clue for enzyme function". In: II ESCOLA DE MODELAGEM MOLECULAR EM
SISTEMAS BIOLOGICOS, 2004, Petropolis: LNCC, Brazil, 2004.
8.34.
Neshich, Goran; MANCINI, Adauto; HIGA, Roberto
Hiroshi; KUSER, Paula; MICHEL, Yamagishi "Gold STING: the new DB and
concept in protein structure/function data visualisation/analysis".
In: SBBQ XXXIII, 2004, Caxambu. Brazil, 2004.
8.35.
Neshich, Goran; MANCINI, Adauto; KUSER, Paula;
FILETO, Renato; MICHEL, Yamagishi; HIGA, Roberto Hiroshi "Gold STING:
studying protein stability and folding by looking at an extensive DB of
the structure descriptors". In: ISMB 2004, 2004, Glasgow. ISMB 2004.
Scotland, 2004.
8.36.
Neshich, Goran; MANCINI, Adauto; KUSER, Paula;
FILETO, Renato; MICHEL, Yamagishi; HIGA, Roberto Hiroshi "Selecting a
set of the protein structure descriptors uniquely defining the active site
residues". In: 3D-SIG: ISMB 2004, 2004, Glasgow. ISMB 2004. Scotland,
2004.
8.37.
HERNANDEZ, Jorge Fernandez; NESHICH, Goran;
CM, Camargo Antonio. "USING BRADYKININ POTENTIATING PEPTIDE (BPP) STRUCTURES
TO DEVELOP NEW ANTIHIPERTENSIVE DRUGS" In: ICOBICOBI, 2004, Angra dos Reis.
Brazil. 2004.
8.38.
NESHICH, Goran; KUSER, Paula; JESUS,
Katia Regina Evaristo de; MANCINI, Adauto; MICHEL, Yamagishi; RENATO, Fileto;
ROBERTO, Higa. "The signals hidden in a set of protein structure descriptors:
in silico identifying a protein active site". In: 1ST LATIN AMERICAN PROTEIN
SOCIETY MEETING, 2004, Angra dos Reis. Brazil. 2004.
8.39.
NESHICH, Goran; JESUS, Katia Regina
Evaristo de; KUSER, Paula; MICHEL, Yamagishi; MANCINI, Adauto; RENATO, Fileto;
ROBERTO, Higa. "Identifying a protein active site in silico by selecting
for the signals hidden in a set of protein structure descriptors" In: ICOBICOBI,
2004, Angra dos Reis. Brazil. 2004.
8.40.
NESHICH, Goran; MANCINI, Adauto; HIGA, Roberto
Hiroshi; KUSER, Paula; MICHEL, Yamagishi. Gold STING: the new DB and concept
in protein
structure/function data visualisation/analysis. In: SBBQ XXXIII, Brazil,
Caxambu. 2004.
8.41.
NESHICH, Goran; YAMAGISHI, M. E.
B. ; ROCCHIA, Walter ; MANCINI, Adauto ; FALCÃO, Paula Regina Kuser ; FILETO,
Renato ; BAUDET, Christian ; PINTO, Ivan ; MONTAGNER, Arnaldo ; PALANDRANI,
Juliana ; KRAUCHENKO, João ; TORRES, Renato Cristiano ; BEZERRA, George
Barreto Pereira ; SOUZA, Sávio ;TOGAWA, Roberto C. ; HIGA, Roberto
Hiroshi . " Protein Structure Analysis and Visualization Using Java Protein
Dossier". In: International Conference on Chemometrics and Bioinformatics
in Asia, 2004, Shanghai. Proceedings of International Conference on Chemometrics
and Bioinformatics in Asia, China, ,p. 128-128.2004
2005
8.42.
KUSER, Paula; YAMAGISHI, Michel; MANCINI, Adauto; HIGA, Roberto;
BORRO, Luiz C; NESHICH, Goran. "STING - A web
server for comprehensive analysis of protein structure and sequence" In:
ISMB 2005, 2005, Detroit. USA ISMB proceedings. 2005
8.43.
KUSER, Paula; YAMAGISHI, Michel; MANCINI, Adauto; BORRO, Luiz
C; NESHICH, Goran. "Identification of folding
essential residues by looking at an extensive DB of the structure descriptors
in Diamond STING" In: ISMB 2005, Detroit. USA ISMB 2005 proceedings.
2005.
8.44.
Marcelo G. Narciso, Michel E. B. Yamagishi, Thiago Quinalia, George
B. P. Bezerra, Goran Neshich. "2D Maps of Protein
Interface Surfaces" In: X-Meeting Brazil, Caxambu. 2005
8.45.
Michel E. B. Yamagishi, George B. P. Bezerra, Thiago Quinalia, Paula R.
Kuser, Roberto H. Higa, Adauto L. Mancini, José G. Jardine, Ivan Mazoni,
Edgard H. dos Santos, Sérgio A. B. Cruz, Stanley R. M. Oliveira, Goran
Neshich. "An Interative Protein Interface Surface Java Viewer" In:
X-Meeting, Brazil, Caxambu. 2005
8.46.
Roberto Hiroshi Higa, Sergio Aparecido Braga da Cruz, Paula Regine Kuser,
Michel Eduardo Beleza Yamagishi, Renato Fileto, Adauto Luiz Mancini and
Goran Neshich. "Building Multiple Sequence
Alignments with a flavor of HSSP alignments". In: X-Meeting, Brazil,
Caxambu. 2005
8.47.
Sergio A. B. da Cruz, Ivan Mazoni, Stanley R. M. Oliveira, Michel E. B.
Yamagishi, Paula R. Kuser, Edgard H. Santos, Fabio D. Vieira, Roberto H.
Higa, Adauto L. Mancini, Goran Neshich. "JMOL
and STING integration: a STING for multiple platform". In: X-Meeting, Brazil,
Caxambu. 2005
8.48.
Guelfi, A.; Chabregas, S. M.; Falco, M. C., Falcão, P. K., Neshich,
G.; Azevedo R. A.; "Molecular Dynamics Analysis of Glutathione Transferases
Sugarcane Mutants and Their Interactions With Atrazine". In: X-Meeting,
Brazil, Caxambu. 2005
8.49.
José G. Jardine, Goran Neshich, Paula R. K.
Falcão, Michel E. B. Yamagishi, Stanley R. M. Oliveira, Sérgio Marangoni,
Daniel Martins, Flavia V. Winck, José C. Novello. "Molecular Modeling of
the Protein Twitching Motility of Xylella fastidiosa" In: X-Meeting,
Brazil, Caxambu. 2005
8.50.
Mariana Simões, Diana Bahia, Kleider Torres, Adhemar Zerlotini Neto, François
Artiguenave, Paula Kuser, Goran Neshich, Guilherme
Oliveira. "SNP Identification in Schistosoma mansoni Expressed
Genes". In: X-Meeting, Brazil, Caxambu. 2005
8.51.
Stanley R. M. Oliveira, Daniel S. Pavanelli, Gustavo V. Almeida, Michel
E. B. Yamagishi, Paula . Kuser, Edgard H. Santos, Fabio D. Vieira, Ivan
Mazoni, Sergio A. B. da Cruz, Roberto H. Higa, Adauto L. Mancini, Goran
Neshich. "STING_DB: A relational database of structural parameters
of protein analysis". In: X-Meeting, Brazil, Caxambu.
2005
8.52.
Katia Regina Evaristo de Jesus, Paula Kuser Falcão, Goran
Neshich. "Structural Analyses of Cry 1Ac Protein from Bacillus
thuringiensis" In: X-Meeting, Brazil, Caxambu. 2005
8.53.
Goran Neshich, Paula Kuser, Michel Yamagishi,
Stanley Oliveira, Ivan Mazoni, Edgard Santos, Favio Vieira, Sergio Cruz,
Adauto Mancini, Jose Gilberto Jardine, Roberto Higa. "What makes the active
site amino acids so different from the others: defining the structural descriptors
specific for activity". In: X-Meeting, Brazil, Caxambu.
2005
8.54.
Noboru Furukawa, Yuko Takeno, Goran Neshich
and Akinori Sarai. " Systematic Analysis of Structure-Stability Relationship
for Proteins and Mutants". In: The 16th International Conference on Genome
Informatics, held at PACIFICO YOKOHAMA, December 19-21, 2005., JAPAN,
2005.
8.55.
Paula R. Kuser, Michel E. B. Yamagishi, Luiz C. Borro, Adauto Mancini, Roberto
Higa and Goran Neshich. "Identification of
folding essential residues by looking at an extensive DB of the structure
descriptors in Diamond STING" In: ISMB 2005, Detroit, USA.
2005
2006
8.56.
Stanley R. M. Oliveira, Diego N. Rodrigues , Kassyus R. R. Souza, Ivan,
Gustavo V. Almeida, Paula R. K. Falcão, Michel E. B.Yamagishi, Edgard H.
Santos, Fábio D. Vieira, José G. Jardine and Goran
Neshich; "STING Database Quality Assessment". In: ISMB 2006, Fortaleza.
Brazil ISMB 2006 proceedings, Poster B-33. 2006
8.57.
R.C. Melo, I. Mazoni, G. Neshich, M.M. Santoro
and W. Meira Jr; "Contacts as the key elements for comparing two protein
structures". In: ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings - Poster
I-6. 2006
8.58.
R.C. Melo, I. Mazoni, G. Neshich, M.M. Santoro
and W. Meira Jr; "Protein structure topology comparison based on contact
maps". In: ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings,
Poster I-5. 2006
8.59.
Michel E. B. Yamagishi, Paula R. Kuser1, Luiz C. Borro, Stanley Oliveira,
Edgar H. Santos, José G. Jardine, Fábio D. Vieira, Ivan Mazoni and Goran
Neshich; "Analysing Protein-Protein Interface using the STING
JPIV". In: ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings, Poster I-14.
2006
8.60.
Michel E. B. Yamagishi, Stanley Oliveira, Luiz C. Borro , Edgar H. Santos,
José G. Jardine, Fábio D. Vieira, Ivan Mazoni, Paula R. Kuserand Goran
Neshich; "Predicting Enzyme Class From Protein Structural Parameters
Using STING_DB parameters and Bagging Predictors". In: ISMB 2006, Fortaleza.
Brazil ISMB 2006 proceedings, Poster I-13. 2006.
8.61.
José G. Jardine, Goran Neshich; Paula R. K.
Falcão, Michel E. B.Yamagishi, Stanley R. M. Oliveira, Juliana M. Papine,
Mariana S. Vieira; "Structural Analysis of proplasmepsin from the human
malarial pathogen plasmodium vivax". In: ISMB 2006, Fortaleza. Brazil
ISMB 2006 proceedings, Poster I-34. 2006
8.62.
Jorge Hernandez Fernandez, Vanessa Rioli, Goran
Neshich, Emer S.Ferro, Fernanda C. Portaro, Antonio Carlos M. Camargo;
"Dynamics of catalysis and inhibition in oligopeptidases: Natural peptide
structures as promising antihypertensive agents". In: ISMB 2006, Fortaleza.
Brazil ISMB 2006 proceedings, Poster E-8 . 2006
8.63.
Paula R. Kuser, Michel E. B. Yamagishi, Stanley R. M. Oliveira, Ivan Mazoni
Edgard H. Santos, Fábio D. Vieira, José G. Jardine Luiz C. Borro and Goran
Neshich; "BlueStar STING - A multiplatform environment for protein
structure analysis". In: ISMB 2006, Fortaleza. Brazil ISMB
2006 proceedings, Poster I-22. 2006
8.64.
José G. Jardine, Goran Neshich; Paula R. K.
Falcão, Michel E. B.Yamagishi, Stanley R. M. Oliveira, Ivan Mazoni, Edgard
H. Santos, Fábio D. Vieira, Sérgio Marangoni; Daniel Martins; Flavia V.
Winck; José C. Novello; "Structural Analysis of the Protein Twitching Motility
of Xylella fastidiosa". In: ISMB 2006, Fortaleza. Brazil
ISMB 2006 proceedings, Poster I-35. 2006
8.65.
Stanley R. M. Oliveira, Diego N. Rodrigues , Kassyus R. R. Souza, Gustavo
V. Almeida, Goran Neshich, Paula R. K. Falcão,
Michel E. B.Yamagishi, Edgard H. Santos, Fábio D. Vieira, José G. Jardine;
"An Integrated database of structural parameters for protein analysis".
In: ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings,
Poster B-44. 2006
8.66.
Katia Regina Evaristo de Jesus, Paula Kuser Falcão, Goran
Neshich; "The Cry 1Ac Protein from Bacillus thuringiensis
and its structure stability centers". In: ISMB 2006, Fortaleza. Brazil
ISMB 2006 proceedings, Poster I-47. 2006
8.67.
Cristina Ribeiro, M.M. Santoro, Goran Neshich;
"Serine Proteases analisys based on phylogenetic trees constructed from
the sequence and structure alignments". In: ISMB 2006, Fortaleza. Brazil
ISMB 2006 proceedings, Poster LB-39 and I-48. 2006
8.68.
Ivan Mazoni, Paula R. Kuser-Falcão, Michel E. B. Yamagishi, Luiz
C. Borro, José G. Jardine, Edgard H. dos Santos, Stanley R. M. Oliveira,
Goran Neshich; "MSSP: simultaneous comparison
of the same structure descriptor for different protein structures". In:
ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings, Poster
I- 50. 2006
8.69.
Luiz C. Borro, Ivan Mazoni, Paula R. Kuser-Falcão, Michel E. B.Yamagishi,
José G. Jardine, Edgard H. dos Santos, Stanley R. M. Oliveira, Goran
Neshich; "Protein Ligand Contacts Analysed In An Integrated Environment
With Other Structure And Sequence Related Parameters". In: ISMB 2006, Fortaleza.
Brazil ISMB 2006 proceedings, Poster I49. 2006
8.70.
Marcelo Narciso, Ivan Mazoni, Paula R. Kuser-Falcão, Michel E.
B. Yamagishi, José G. Jardine, Edgard H. dos Santos, Stanley R. M. Oliveira,
Goran Neshich; "Comparison of AA co-evolution
and correlated structure descriptors". In: ISMB 2006, Fortaleza. Brazil
ISMB 2006 proceedings, Poster I-51. 2006
8.71.
Stanley R. M. Oliveira, Diego N. Rodrigues, Kassyus R. R. Souza, Gustavo
V. Almeida, Goran Neshich, Paula R. K. Falcão,
Michel E. B.Yamagishi, Edgard H. Santos, Fábio D. Vieira, José G. Jardine;
"Sting_RDB: A Relational Database of Structural Parameters for Protein Analysis"
In: ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings,
Demo. 2006
8.72.
Marcelo G. Narciso, Michel E. B.Yamagishi, Paula R. K. Falcão and
Goran Neshich, "2D Maps of Protein Surface". In: ISMB 2006, Fortaleza.
Brazil ISMB 2006 proceedings, Poster B-63. 2006
8.73.
Maria Cristina Mattar da Silva, Fabíola Rodrigues Teixeira, Cleiton C.M,
da Cruz, Roberto Togawa, Goran Neshich and
Maria Fatimaosé Grosse de Sá; "In vitro Molecular Expression of Bean Alpha-Amulase
Inhibitors -Investigating Specificity of Binding to Alpha Amylases". In:
ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings,
Poster LB-28. 2006
8.74.
Marcelo Mendes Brandão, Paula R. K. Falcão and Goran
Neshich, "Structural Parameters to Filter Crucial Catalytic Site
Amino Acids from Fructose 1,6- Biphosphate Aldolase". In: ISMB 2006, Fortaleza.
Brazil ISMB 2006 proceedings, Poster I-21. 2006
8.75.
Marcos Tadeu Santos, Lucio Fabio Caldas Ferraz, Fernanda de Castro Reis,
Ana Paula Felicio, Paula R. K. Falcão, Maria Teresa marques Novo,
Goran Neshich, Oswaldo Garcia Jr, Laura Maria Mariscal Ottoboni;
"Sequence Analysis of the Riboflavin Biosythesis Genes from Acidithiobacillus
ferrooxidans". In: ISMB 2006,Fortaleza. Brazil ISMB 2006
proceedings, poster H-76. 2006
8.76.
Lucio Fabio Caldas Ferraz, Fernanda de Castro Reis, Marcos Tadeu Santos,Ana
Paula Felicio, Paula R. K. Falcão, Maria Teresa marques Novo,
Goran Neshich, Oswaldo Garcia Jr, Laura Maria Mariscal Ottoboni;
"Molecular Modelling of the Riboflavin Genes from Acidithiobacillus ferrooxidans".
In: ISMB 2006, Fortaleza. Brazil ISMB 2006 proceedings,
Poster I-90. 2006
8.77.
Fernanda de Castro Reis, Lucio Fabio Caldas Ferraz, Marcos Tadeu Santos,
Paula R. K. Falcão, Goran Neshich and Laura
Maria Mariscal Ottoboni; "Molecular Modelling of polypeptide deformylase
from Acidithiobacillus ferrooxidans". In: ISMB 2006, Fortaleza. Brazil
ISMB 2006 proceedings, Poster I-95. 2006
8.78.
Lucio Fabio Caldas Ferraz, Fernanda de Castro Reis, Paula R. K. Falcão,
Goran Neshich and Maricilda Palandi de Melloi;
"Molecular Homologous Modelling of 3B-HSD2 Mutant Enzyme: Structure-Function
Aspects of PRO222GLN Mutation Correlates with the Experimental data from
a Patient with Congenital Adrenal Hyperplasia". In: ISMB 2006, Fortaleza.
Brazil ISMB 2006 proceedings, Poster D-12. 2006
8.79.
Marcelo G. Narciso; Goran Neshich; Michel B.Yamagishi; Paula Falcão;
Edgar Henrique; Fábio D.Vieira; José G.Jardine; Ivan Mazoni
" Aspectos computacionais da análise da co-evolução
de aminoácidos que pertencem a uma proteína qualquer usando
o software Sting". II Congresso de Computação do Sul
de Mato Grosso - COMPSULMT2006 16 a 20 de outubro de 2006 Rondonópolis,
MT
8.80.
Marcelo G. Narciso;Michel B.Yamagishi;Goran Neshich; Paula Falcão;
Edgar Henrique; Fábio D. Vieira; José G. Jardine; Ivan Mazoni
"Transformação de imagens 3D para 2D para análise
de proteínas usando o software Sting". II Congresso de Computação
do Sul de Mato Grosso - COMPSULMT2006 16 a 20 de outubro de 2006
Rondonópolis, MT
2007
8.81.
Luiz César Borro, Ivan Mazoni, Daniel Alvarenga, Thais Vital Pelligrinelli,
Mauri Carvalho, José Gilberto Jardine and Goran Neshich;
"Chameleon sequences seen under a prism of structure descriptors". In: X-meeting
2007, São Paulo. Brazil. X-meeting proceedings, Poster
XP190. 2007
8.82.
Ivan Mazoni, Luiz César Borro, Daniel Alvarenga,
José Gilberto Jardine and Goran Neshich; "JavaSecondary
Structure Dossier". In: X-meeting 2007, São Paulo. Brazil.
X-meeting proceedings, Poster XP48. 2007
8.83.
José Gilberto Jardine, Goran Neshich, Ivan
Mazoni, Daniel Martins, Sérgio Marangoni, José Camillo Novello, Wagner F.
Gattaz, Emmanuel Dias-Neto; "Molecular Homologous Modelling of 3B-HSD2 Mutant
Enzyme: Structure-Function Aspects of PRO222GLN Mutation Correlates with
the Experimental data from a Patient with Congenital Adrenal Hyperplasia".
In: X-meeting 2007, São Paulo. Brazil. X-meeting proceedings,
Poster XP40. 2007
8.84.
Cristina Ribeiro, Marcelo Santoro, Goran
Neshich; "Protein Dossier and Protein Fingerprints produce Surface
Signatures: A simple and powerful technique for coding and comparing compound
and receptor shape information". In: X-meeting 2007, São Paulo. Brazil.
X-meeting proceedings, Poster XP 220. 2007
8.85.
Raquel Melo, Janaína Gomide, Wagner Meira
Jr., Júlio Lopes, Goran Neshich, Marcelo
Santoro; "Mining Structural Signatures in Proteins using Intrachain
Interactions". In: X-meeting 2007, São Paulo. Brazil.
X-meeting proceedings, Poster XP15. 2007
2008
8.86.
Ivan Mazoni, Luiz César Borro, Daniel Alvarenga, Pablo Lira Cecilio,
José Gilberto Jardine, Adauto Mancini and Goran
Neshich; “Dossier of Secondary Structure Elements Amino Acid Properties”.
In: ISMB 2008 July 18 to 23, Toronto. Canada.
8.87.
Mazoni I., Borro L.C., Alvarenga D., Jardine J.G., Goran
Neshich; “STUDYING STRUCTURE FUNCTION RELATIONSHIP OF PROTEINS USING
“REMEDIATED” PDB FILES ”. In: SBBq 2008 May 17 to 20, Águas
de Lindóia. Brazil.
8.88. Mazoni I., Jardine J.G, Borro L.C., Alvarenga D., Goran
Neshich; “ELECTROSTATIC POTENTIAL AT THE ALPHA CARBON ATOMS ALONG
THE ALPHA HELICES AND BETA STRANDS ”. In: SBBq 2008 May 17 to 20,
Águas de Lindóia. Brazil.
8.89. Jardine J.G., Mazoni I., Borro L.C., Alvarenga D., Goran
Neshich; “SIGNATURE CONTACT COORDINATION PATTERNS FOR SECONDARY STRUCTURE
ELEMENTS IN PROTEIN STRUCTURES ”. In: SBBq 2008 May 17 to 20, Águas
de Lindóia. Brazil.
8.90. Jardine J.G., Mazoni I., Mancini A., Borro L.C., Alvarenga
D., Cecilio P.L, Pelligrinelli T.V. and Goran Neshich;
“HOW DID THE STRUCTURE FUNCTION DESCRIPTORS OF PROTEINS CHANGE WITH INTRODUCTION
OF "REMEDIATED" PDB FILES”. In: RIB 2008 October 15 to
17, Santiago. Chile.
8.91. Mancini A., Jardine J.G., Mazoni I., Borro L.C., Alvarenga
D., Cecilio P.L, Pelligrinelli T.V. and Goran Neshich;
“Structure Descriptors of Chameleon Sequences ”. In: RIB 2008 October
15 to 17, Santiago. Chile.
8.92. Borro L.C., Mazoni I., Alvarenga D., Cecilio P., Grassi, J.A., Mancini A., Jardine J.G. and Goran Neshich; “CONTACT COORDINATION PATTERNS AND ELECTROSTATIC POTENTIAL AT ALPHA CARBON ATOMS: A DOSSIER OF PROTEIN SECONDARY STRUCTURE ELEMENTS”. In: EMBnet Conference 2008: 20th Anniversary Celebration, 2008 September 18 - 20, Martina Franca (Puglia), Italy.
8.93. Izabella Pena ; MANCINI, Adauto L. ; MAZONI, Ivan ; JARDINE, Jose Gilberto ; Neshich, Goran ; José Miguel Ortega . "Identification of phylogenetic relationship between GDPD and SMaseD proteins based on active site amino acid physical chemical properties". In: x-meeting, 2008, Salvador, BA. x-meeting 2008, 2008, Brazil.
2009
8.94.
NESHICH, IAP; DE MORAES, FR; MARANGONI, S; MARTINS, D; SALIM, JA; MAZONI,
I; MANCINI, A; NESHICH, G; JARDINE, JG; “XYLELLA
FASTIDIOSA HEXAMERIC PILUS RETRACTION MOTOR PILT INTERFACES ARE MAINTAINED
BY NON-HYDROPHOBIC CONTACTS”. In: X-meeting, 2009, Angra
dos Reis, RJ, Brazil
8.95.
NESHICH, IAP; DE MORAES, FR; SALIM, JA; MAZONI, I; MANCINI, A; JARDINE,
JG; NESHICH, G; “SURFACE
HYDROPHOBICITY INDEX (SHI): INSIGHT INTO THE MECHANISMS OF PROTEIN-PROTEIN
ASSOCIATIONS”. In: X-meeting, 2009, Angra dos Reis,
RJ, Brazil
8.96.
JARDINE, JG; NESHICH, IAP; DE MORAES, FR; MAZONI, I; MANCINI, A; SALIM,
JA; NESHICH, G; “GENERATION
OF LIPASE B MUTANTS WITH INCREASED SURFACE HYDROPHOBICITY IN ORDER TO IMPROVE
BIODIESEL CATALYSIS.”. In: X-meeting, 2009, Angra dos
Reis, RJ, Brazil
8.97.
MAZONI, I; BORRO, LC; MANCINI, AL; SALIM, JA; MORAES, FR; JARDINE, JG;
NESHICH, IP; NESHICH, G; “COMPUTATIONAL
ANALYSIS OF THE SECONDARY STRUCTURE ELEMENTS BASED ON THE PHYSICAL CHEMICAL
AND GEOMETRICAL DESCRIPTORS AND STATISTICS DATA”. In:
X-meeting, 2009, Angra dos Reis, RJ, Brazil
8.98.
MAZONI, I; BORRO, LC; MANCINI, AL; SALIM, JA; MORAES, FR; JARDINE, JG;
NESHICH, IP; NESHICH, G; “COMPARISON
BETWEEN PHYSICAL CHEMICAL AND GEOMETRICAL CHARACTERISTICS OF THE AMINO ACIDS
PRESENT IN ALPHA-HELICES AND BETA-SHEETS”. In: X-meeting,
2009, Angra dos Reis, RJ, Brazil
8.99.
SALIM, JA; MAZONI, I; MANCINI, AL; MORAES, FR; JARDINE, JG; NESHICH,
IP; NESHICH, G; “MSSP: A
WEB-BASED APPLICATION FOR ANALYSIS OF SELECTED PARAMETER FROM MULTIPLE STRUCTURES
IN A GRAPHICAL MANNER”. In: X-meeting, 2009, Angra dos
Reis, RJ, Brazil
2010
8.100.
Cristina Michiko Yokoyama Cardoso, Fábio Rogério de Moraes,
Goran Neshich, Edith Cibelle de Oliveira Moreira,
Carinne de Nazaré Monteiro Costa, Rafaela Cabral dos Santos and Cláudia
Regina Batista de Souza; “Identification of cDNA sequences coding
for bZIP regulatory proteins predicted to interact with putative cis-acting
elements from Be2S1 gene”. In: Congresso Brasileiro de Biotecnologia,
2010, Fortaleza-CE, Brazil.
8.101.
Anjos, E.F., Ferreira, P.A.; de Fátima, A., Reis, F.S., de Moraes,
F.R., Neshich, G., Milani, R., Aoyama, H.,
Ferreira, CV; “Calix[6]arene, a Novel Compound Acting as a Strong
Inhibitor of the Low Molecular Weight Protein Tyrosine Phosphatase”.
In: XXXiX Reunião Anual da Sociedade Brasileira de Bioquimica e Biologia
Molecular SBBq 2010, Foz do Iguaçu, Parana, Brazil.
8.102.
Brandão, MM; Arruda, LH; Moura, DS, Neshich,
G; Pereira, JGC; Malagó, W. Jr Silva-Filho, MC; “A pipeline
to study Structural Interactions among Spodoptera frugiperda Serine Proteinases
and Plant Proteinase Inhibitors”. In: 56 Congresso Brasileiro de Sociedade
Brasileira de Genética (SBG), 2010, Guaruja-SP, Brazil.
8.103.
Goran Neshich, Izabella AP Neshich, Jose
Augusto Salim, Fabio R. de Moraes, Ivan mazoni, Adauto Mancini e Jose Gilberto
Jardine; “Comparing Physical Chemical Characteristics of T SOD1 and
A4V mutant, The structures of which were previously aligned by using "STING_MSSP"
- applications in therapeutic research”. In: TACBAC 2010, Cambridge,
UK.
8.104.
José Augusto SALIM, Ivan MAZONI, Adauto MANCINI, Izabella A.
P. NESHICH1, Fábio R. DE MORAES, José G. JARDINE, Goran
NESHICH; “Multiple Structures - Selected Parameter (MSSP) 2D
Plot”. In: Vizbi 2010, EMBL, Heidelberg, , Germany.
8.105.
Izabella A. P. NESHICH1, Fábio R. DE MORAES,José Augusto
SALIM, Ivan MAZONI, Adauto MANCINI, José G. JARDINE, Goran
NESHICH; “Surface Hydrophobicity Index (SHO); Insights into
the relationship between hydrophobic effect and Oligomerization”.
In: Vizbi 2010, EMBL, Heidelberg, , Germany.
2011
8.106.
BRANDAO, M. M. ; ARRUDA, L. H. ; MOURA, D. S. ; Neshich,
G ; NESHICH, I. P. ; PEREIRA, J. G. C. ; MALAGO JUNIOR, W. ; SILVA
FILHO, M. C. . Structural and Phylogenetic Analysis of Spodoptera frugiperda
Chymotrypsins Involved on Insect Chemical Protective Barrier Against Plant
Proteinase Inhibitors (PIs). In: XL Annual Meeting of The Brazilian of Biochemistry
and Molecular Biology Society (SBBq), 2011, Foz do Iguaçu - PR, Brazil.
SBBq Poster Abstracts, 2011.
8.107.
NESHICH, I.A.P. ; HAYASHI, M. A. F. ; Neshich,
G . Structural Characterization Of MK-801 Binding Site Through Spatial
And Physical-Chemical Properties On NMDAR-Mimicking AMPA-Glur Mutants .
In: XL Annual Meeting of The Brazilian of Biochemistry and Molecular Biology
Society (SBBq), 2011, Foz do Iguaçu - PR, Brazil.
SBBq Poster Abstracts, 2011.
8.108.
DE MORAES, F. R. ; VILLANUEVA, W. J. P. ; NESHICH, I.A.P. ; Mazoni, I ;
NISHIMURA, L. ; SALIM, J. A. ; Jardine, Jose G ; Von Zuben, F ; Neshich,
Goran . SIPEPPI, a Systematic Neuron Network-based Methodology for
Predicting Protein-Protein Interfaces using STING Database descriptors.
In: XL Annual Meeting of The Brazilian of Biochemistry and Molecular Biology
Society (SBBq), 2011, Foz do Iguaçu - PR, Brazil.
SBBq Poster Abstracts, 2011.
8.109.
Mazoni, I ; SALIM, J. A. ; NESHICH, I.A.P. ; NISHIMURA, L. ; Jardine, JG
; Neshich, G . Structure function relationship
de convoluted to a level of physical chemical descriptors: case study lysozyme
/ lactalbumine differences . In: XL Annual Meeting of The Brazilian of Biochemistry
and Molecular Biology Society (SBBq), 2011, Foz do Iguaçu - PR,
Brazil. SBBq Poster Abstracts, 2011.
8.110.
NESHICH, I.A.P. ; Mazoni, I ; SALIM, J. A. ; DE MORAES, F. R. ; NISHIMURA,
L. ; Jardine, JG ; Neshich, G . Pathogenic
Prion Proteins (PrP) have higher Electrostatic Potential pattern than normal
cellular Prion Protein in a specific region . In: XL Annual Meeting of The
Brazilian of Biochemistry and Molecular Biology Society (SBBq), 2011, Foz
do Iguaçu - PR, Brazil. SBBq Poster Abstracts, 2011.
8.111.
De Moraes, F.R., Anjos, E.F., Ferreira, P.A., de Fátima, A., Reis,
F.S., Milani, R., Galembeck, E., Aoyama, H., Ferreira, C.V., Neshich,
G. MOLECULAR DYNAMICS STUDY OF INTERACTION BETWEEN LOW MOLECULAR
WEIGHT PROTEIN TYROSINE PHOSPHATASE AND CALIX[6]ARENE. EBMM – 2011.
Universidade Federal do ABC, Santo André - SP, Brazil
2012
8.112.
Salim, J.A.; de Moraes F. R., Neshich, I.A.P.; Mazoni, I.; Jardine, J.G.;
Von Zuben, F.; Neshich, G.: "A Pattern
Recognition Approach for Catalytic Site Residues Prediction using
STING Structural Protein Descriptors". XLI Annual Meeting of SBBq,
Foz de Iguaçu, PR, Brazil
8.113.
Mazoni, I.; Salim, J.A.; de Moraes F. R., Yano, I.H., .; Jardine, J.G.;
Neshich, I.A.P.; ; Neshich, G.: "Prediction
of ?-helix Using Data Mining Decision Tree Technique".
XLI Annual Meeting of SBBq, Foz de Iguaçu, PR, Brazil
8.114.
Salim, J.A.; Von Zuben, F.; de Moraes F. R., Neshich, I.A.P.; Mazoni, I.;
Jardine, J.G.; ; Neshich, G.: "CHARACTERIZATION
OF CATALYTIC SITE RESIDUES USING STING_DB STRUCTURAL DESCRIPTORS".
3D SIG Structural Bioinformatics and Computational Biophysics - ISMB 2012,
Long Beach, Ca, USA
8.115.
Neshich, I.A.P.; de Moraes F. R.,; Salim, J.A.; Mazoni, I.; Jardine, J.G.;
; Neshich, G.: "SIZE MATTERS: SURFACE
HYDROPHOBICITY INDEX (SHI) DESCRIBES THE IMPACT OF THE SIZE OF INTERFACE
AREA ON OLIGOMERIZATION DRIVEN BY HYDROPHOBIC EFFECT". 3D SIG Structural
Bioinformatics and Computational Biophysics - ISMB 2012, Long Beach, Ca,
USA
2015
8.116.
Borr, L.; Neshich, G.: "Ranking optimization
in virtual screening using physical-chemical and structural descriptors
of the nano-environment for protein-ligand interactions".Drugs for
Neglected Diseases initiative, July 2015, Campinas, Brazil
8.117.
Fulaz, S.F.; Cabrini, F.M.; Borro, L.; Tasic, L.; Neshich,
G.: " Computacional Biology tools in design of an agrochemical
against Xylella fastidiosa". XLVI Annual Meeting of SBBq, Foz de Iguaçu,
PR, Brazil.
8.118.
Borro, L.C.; Salim, J.A.; Mazoni, I.; Yano, I.; Jardine, J.G.;
Neshich, G.:"Improving binding affinity prediction by using
a rule-based model with physical-chemical and structural descriptors of
the nano-environment for protein-ligand interactions". XLVI Annual
Meeting of SBBq, Foz de Iguaçu, PR, Brazil.
8.119.
Fulaz, S.F.; Cabrini, F.M.; Borro, L.; Tasic, L.; Neshich,
G.: " Computacional Biology tools in design of an agrochemical
against vaiedade dos alvos em Xylella fastidiosa PilT protein". XXXIII
Congresso de Iniciação Cientifica da Unicamp, 17-19 Novembro
de 2015, Campinas, Brazil.
2016
8.120.
FULAZ, S.F., CABRINI, F.M., CARVALHO, D.P., BORRO, L.C., SANTOS, C. A.,
BELOTI, L., SOUZA, A. P., TASIC, L. Neshich, G.:
"DESIGN OF INHIBITORS FOR THE PILT PROTEIN FROM XYLELLA FASTIDIOSA
USING IN SILICO AND IN VITRO APPROACHES; "45 Annual Meeting of SBBq,
Natal, RN, June 2016, Brazil
8.121.
SCHULTZ, L.G., VILLALTA-ROMERO, F.G., BORRO, L.C.,JARDINE, J.G., TASIC,
L. Neshich, G.:
"THE HOST/GUEST INTERACTIONS OF THE KEY PROTEIN FOR THE BIPOLAR DISORDER"
; 45 Annual Meeting of SBBq, Natal, RN, June 2016, Brazill.
8.122.
Campeiro, J, neshich, I, Santanna, OA, Lopes, R, Inazer, D, Assakura,
MT, Hayashi, MAF, Neshich, G.:"Identificação
de sequencias BPPS-similares no cerebro de rato utilizando um anticorpo
policlonal com alta especificidade". Fesbe, SP, SP, Brazil.
8.123.
Borro, L.; Yano IH, Mazoni, I; Neshich, G.:
" Binding affinity prediction using a nonparametric regression model
based on physicochemical and structural descriptors of the nano-environment
for protein-ligand interactions". ISMB 2016, Orlando, Fl, USA
9.1.1. "Disulphide bridge determination in 2S albumin from Brazil
nut (Bertholetia excelsa H.B.K.)
9.1.2. author: Maria Cristina Mattar da Silva
9.1.3. degree: Msc, UnB - Brasilia, Brazil
9.1.4. participation: thesis adviser
9.1.5. Finalized: 1993
9.2.1. "Purification and the partial amino-acid sequence of the
tripsin- chymotripsin inhibitor from the Dolichos labiab cv albiflorus seeds"
9.2.2. author: Marcelo Silveira de Alcantra
9.2.3. degree: Msc, UnB - Brasilia, Brazil
9.2.4. participation: committee member
9.2.5. Finalized: 1994
9.3.1. "Secondary structure prediction of the globular proteins:
structure prediction software design - COMBO, and its utilization for the
analysis of the C-terminal region of the proteins binding to poly-A (PABP)”
9.3.2. author: Antonio Francisco Pereira de Araújo
9.3.3. degree: Msc, UnB - Brasilia, Brazil
9.3.4. participation: committee member
9.3.5. Finalized: 1994
9.4.1. "Structural analysis of Piruvate Decarboxilase from Saccharomyces
cerevisiae"
9.4.2. author: Maria Angela Lopes de Almeida Arrazonas
9.4.3. degree: Ph.D., UNICAMP - Campinas, Brazil
9.4.4. participation: committee member
9.4.5. Finalized: 1994
9.5.1. "Trypsine and Chymotrypsine inhibitor from Vigna unguiculata
(L.) Walp: Modeling of three dimensional structure by homology, Thermodynamics
and Kinetics of the interaction with a-Chymotrypsine"
9.5.2. author: Sonia Maria de Freitas
9.5.3. degree: PhD., UnB - Brasilia, Brazil
9.5.4. participation: committee member
9.5.5. Finalized: 1995
9.6.1. "Inibidores de Proteinase do Tipo Bowman-Birk: Evolução Molecular,
Expressão na Superfície de Fagos Filamentosos e seu Papel na Interação Planta-Inseto"
9.6.2. author: Marcia Ometto de Mello Alves José
9.6.3. degree: PhD., ESALQ/USP, Piracicaba, Brazil
9.6.4. participation: committee member
9.6.5. Finalized: 2002
9.7.1. "Structure Function Relationship for Glutationa S transferase
proteins "
9.7.2. author: Andrea Guelfi
9.7.3. degree: PhD., ESALQ/USP, Piracicaba, Brazil
9.7.4. participation: committee member
9.7.5. Finalized: 2006
9.8.1. "In Silico analysis of the patterns in interactions established
between the serion proteases and their inhibitors"
9.8.2. author: Cristina Ribeiro
9.8.3. degree: PhD., UFMG, Belo Horizonte, Brazil
9.8.4. participation: co-advisor
9.8.5. Finalized: 2010
9.9.1. "Globulins and their internal contact motifs analysed togather
with other structure descriptors"
9.9.2. author: Carlos Henrique da Silveira
9.9.3. degree: PhD., UFMG, Belo Horizonte, Brazil
9.9.4. participation: co-advisor
9.9.5. Finalized: 2008
9.10.1. "Predicting hydrogen atom positions in proteins using neural
networks"
9.10.2. author: Adauto Luiz Mancini
9.10.3. degree: MSc., UFSCAR, Sao Carlos, Sao Paulo,
Brazil
9.10.4. participation: co-advisor
9.10.5. Finalized: 2008
9.11.1. "Protein classification based on internal contact patterns"
9.11.2. author: Raquel Melo
9.11.3. degree: PhD., UFMG, Belo Horizonte, Brazil
9.11.4. participation: co-advisor
9.11.5. Finalized: 2008
9.12.1. "TargetsDB - Base de dados de alvos terapêuticosvalidados"
9.12.2. author: Eduardo Campos dos Santos
9.12.3. degree: PhD., UFMG, Belo Horizonte, Brazil
9.12.4. participation: co-advisor
9.12.5. Finalized:2014
9.13.1. "Análise
do nano ambiente propício para nucleação e manutenção
dos elementos da estrutura secundária no contexto estrutural das
proteínas funcionais"
9.13.2. author: Ivan Mazoni
9.13.3. degree: PhD.,
UNICAMP, Campinas, Brazil
9.13.4. participation: advisor
9.13.5. Finalized: in progress
9.14.1. "Predição de epitopos em LiD1, proteína
dermonecrotica do veneno da aranha marrom Loxosceles intermédia por
bioinformática e Imonologia molecular"
9.14.2. author: Ricardo Andrez Machado de Ávila
9.14.3. degree: PhD., UFMG, Belo Horizonte, Brazil
9.14.4. participation: co-advisor
9.14.5. Finalized: 2014
9.15.1. "Desenvolvimento de Interface Web para Docking Automático
de Consenso. "
9.15.2. author: Andrelly Martins Jose
9.15.3. degree: PhD., UFMG, Belo Horizonte, Brazil
9.15.4. participation: co-advisor
9.15.5. Finalized: 2014
9.16.1. "Estudos de comunicação entre as macromoleculas
em homo e hetero complexos atraves das interfaces. "
9.16.2. author: Fábio Rogéio de Moraes
9.16.3. degree:PhD., UNICAMP, Campinas, Brazil
9.16.4. participation: advisor
9.16.5. Finalized: 2012
9.17.1. "Produção de um inibidor para Quinase de Adesão
Focal (FAK) estudos estruturais"
9.17.2. author: João Eustáquio Antunes
9.17.3. degree:PhD., UNICAMP, Campinas, Brazil
9.17.4. participation: co-advisor
9.17.5. Finalized: 2012
9.18.1. "Produção de um compsto quimico simples, substituto
de peptídeo natriurético, o inibidor de receptores do tipo
Guanilato Ciclase."
9.18.2. author: Álisson Campos Cardoso
9.18.3. degree:PhD., UNICAMP, Campinas, Brazil
9.18.4. participation: co-advisor
9.18.5. Finalized: 2013
9.19.1. "Analise dos aspectos estruturais dos inibidores vegetais
de enzymas proteoliticas."
9.19.2. author: Vanessa da Silveira Ramos
9.19.3. degree:PhD., UNICAMP, Campinas, Brazil
9.19.4. participation: co-advisor
9.19.5. Finalized: 2013
9.20.1. "Aspectos estruturais da atividade de um inibidor do tipo
Kunitz de Adenanthera pavonina (APTI)"
9.20.2. author: Desiree Soares da Silva.
9.20.3. degree:PhD., UNICAMP, Campinas, Brazil
9.20.4. participation: co-advisor
9.20.5. Finalized: 2013
9.21.1. "Análise de Padrões de Interação
entre Serino Proteases e seus Inibidores Protéicos"
9.21.2. author: Cristina Ribeiro.
9.21.3. degree:PhD., UFMG, Belo Horizonte, Brazil
9.21.4. participation: co-advisor
9.21.5. Finalized: 2009
9.22.1. "Caracterização estrutural da interação
de serino proteinases de Spodoptera frugiperda (Lepidopteta: Noctuidae)
e inibidores de proteinases de plantas"
9.22.2. author: Ligia Hansen Arruda.
9.22.3. degree:PhD., USP, São Paulo, Brazil
9.22.4. participation: committee member
9.22.5. Finalized: 2011
9.23.1. "Caracterização dos amino acidos da interface
protein-proteina com maior contribuição na energia de ligação
e sua predição a partir dos dados estruturais"
9.23.2. author: José Geraldo de Carvalho Pereira
9.23.3. degree: Mestrado, UNICAMP, Campinas, Brazil
9.23.4. participation: advisor
9.23.5. Finalized: 2012
9.24.1. "Caracterização dos amino acidos pertencentes
ao conjunto que forma o sitio catalitico"
9.24.2. author: José Augusto Salim
9.24.3. degree: Mestrado, UNICAMP, Campinas, Brazil
9.24.4. participation: advisor
9.24.5. Finalized: 2015
9.25.1. "Uso de métodos computacionais para identificação
de epítopos em metaloproteases (snake venom metalloproteases –SVMPs)
e neurotoxinas (NTx) de venenos de serpentes"
9.25.2. author: Edgar Gonzalez Kozlova
9.25.3. degree: PhD, UFMG, Belo Horizonte, Brazil
9.25.4. participation: co-advisor
9.25.5. Finalized: 2016
All packages were designed for network of STING mirrors,available at:
(however, 2017 policies dictated maintenance of the STING platform only
at HOME)
Country
|
www address
|
Status (august 2013)
|
Home (Embrapa/CNPTIA, Campinas - Brazil) | http://www.cbi.cnptia.embrapa.br | Active |
USA: PDB/RCSB at SCSD-UCSD | http://mirrors.rcsb.org/SMS |
Inactive
|
USA: Columbia University | http://trantor.bioc.columbia.edu/SMS/ |
Inactive
|
Spain: CNB-Madrid | http://www.es.embnet.org/SMS/ |
Inactive
|
Japan: Kyushu Institute of Technology (KIT) | http://gibk26.bse.kyutech.ac.jp/SMS/ |
Inactive
|
Argentina: La Plata | http://www.ar.embnet.org/SMS/ |
Inactive
|
Brazil: Embrapa-Cenargen-Brasilia | http://asparagin.cenargen.embrapa.br/SMS |
Inactive
|
10.1.
STING---STING is a WWW tool for the simultaneous display of information
about macromolecular structure (in STING's Graphics Frame) and sequence
(in STING's Sequence Frame). Special attention is given to MacroMolecular
INTERFACE analysis. (1998)
10.2.
STING_PAINT---STINGpaint is WWW tool for - sequence and multiple sequence
alignment coloring - residue/nucleotide within_the_sequence_number identification
- characterization of the immediate environment for any residue/nucleotide
within the sequence. (1998)
10.3.
HORNET---HORNET Specifically shows Hydrogen Bond Net formed between
two protein chains (or protein and DNA). HORNET also shows exact listing
of the Interface Forming Residues (IFR), based on calculated buried surface
area. (1998)
10.4.
MDB_MINING---Molecular Data Base - MDBMining: is a compilation of
a variety of algorithms for retrieving specific data from Protein Databank
(PDB), SwissProt and GenEMBL. Total Residue/Nucleotide occurrence in each
database, keyword search, file sizes, number of chains, resolution of 3D
data, protein families classification are all available in MDBMining. (1999)
10.5.
PDB_MINING---Protein Data Base - PDBMining: is a compilation of a variety
of algorithms for retrieving specific data from Protein Databank (PDB).
Total Residue occurrence in whole PDB, keyword search, file sizes, number
of chains, resolution of 3D data, protein families classification are all
available in PDBMining. (1999)
10.6.
SCORPION---SCORPION is the WWW tool for analysis of the amino acid frequencies
within protein chain(s) (of given pdb file or group of pdb files) as well
as for analysis of 3D contacts of C-alpha and/or Last Heavy Atoms in the
residue side chain (LHA). Convinient Graphical presentation can be used
for identification of specific interactions for given family of the proteins
or given domains. (1999)
10.7.
FORMIGA---FORMIGA is a program that evoluted from SCORPION and is
a WWW tool for analysis of PROTEIN INTERFACES with respect to amino acid
residue frequencies (of given pdb file or group of pdb files) as well as
for analysis of 3D contacts of C-alpha and/or Last Heavy Atoms in the residue
side chain (LHA) for Interface Forming Residues (IFR). Convenient graphical
presentation of calculated parameters makes possible to see specific interactions
on the Protein Interfaces. (1999)
10.8.
HESPER---HESPER: A tool for the analysis of homologous protein families
derived from the HSSP database. (2000)
10.9.
SPIDER---Serine Protease super-family Interface Data Resource (SPIDER)
is an expanding collection of sequence, structural and functional information
about the Serine Proteases Interface Forming Residues located around Active
Site. (2000)
10.10.
EMA---Evaluation of Multiple Alignments: A Comparison of Phylogenetic
trees based on sequence alignments and structure alignments. EMA is a Data
Resource available over WWW. (2000)
10.11.
Ramachandran Plot -- Intelligent graphical presentation of the Ramachandran
Plot using all advantages of Java programming language; Options allow inter
connection of data in dihedral angle plot with 3D structure of the molecule.
A number of subsets among amino acids can be highlighted for better correlation
among 3D structure position and Psi/Pfi spot. (2000)
10.12.
Protein Dossier -- This service provides a graphical report of several
important structural characteristics of the PDB entry. It offers a plot
from PDB cartoon annotated with color coded scales representing for each
amino acid the corresponding temperature factor, solvent accessibility of
the chain in isolation and in complex with the other present chains in PDB
file, sequence conservation in a multiple alignment (relative sequence entropy)
and histograms representing the atomic contacts (as in the Graphical contacts
module), as well as IFR residue identification and IFR contacts. In addition,
comparison of the Secondary Structure annotated by PDB and by DSSP is presented.
(2000)
10.13.
PDB_Cartoon -- Image of the amino acid sequence along with
the secondary structure elements rendered as cartoons. (2000)
10.14.
Contacts -- The atomic contacts between amino acids in a PDB entry received
a special attention. The complete profile of the interactions can be analyzed
in the graphical contacts window, which displays the primary sequence of
a chain and below it a histogram containing the number of contacts made
by the respective residue. Virtual contact line connects residue of interest
with other ones in contact with it, in a form of fan. This presentation
is very intuitive and user can easily grasp contact parameters along the
protein sequence. In case of IFR contacts, IFR are underlined with red line
for easy identification. (2000)
10.15.
ConSSeq -- This service presents PDB file sequence and consensus sequence
(as found in HSSP) colored by conservation, color coded graphic bars of
relative entropy, information about residues present in other homologous
sequences, with their respective frequency. For fast visualization, this
program generates the sequence logo. (2000)
10.16.
Java Ca-Ca Distance plot -- is a diagram where the distances between
the alpha carbon of one residue and all alpha carbon atoms of other residues,
within a single chain of the PDB file, are represented by colored squares
in a symmetrical plot. (2001)
10.17.
Java Cb-Cb Distance plot -- is a diagram where the distances between
the beta carbon of one residue and all beta carbon atoms of other residues,
within a single chain of the PDB file, are represented by colored squares
in a symmetrical plot. (2001)
10.18.
Java MSA -- SMS_MSA stands for the new SMS component: Multiple Sequence
Alignment. Those sequences are extracted both from HSSP and from our own
SH2Qs (Sequences Homologue to the Query [Structure-having] Sequence). The
latter one is designed so that we can benefit from the possibility of making
a choice of the number of sequences that we want to consider in the relative
entropy calculation. SMS_MSA will use standard MSA viewer package: SeaView.
(2001)
10.19.
Java Protein Dossier -- is a interactive presentation of important physical-chemical
characteristics of the macromolecular structure described in PDB file. With
a few mouse clicks the user can access data about chosen parameter, call
other SMS modules or refine the search for specific characteristics. By
using color code scales for each residue of the sequence, JPD shows corresponding:
temperature factor, solvent accessibility of the single chain (and also
in complex with the other present chains in given PDB file), hydrophobicity,
sequence conservation in a multiple alignment (relative entropy), double
occupancy, reliability and histograms representing the atomic contacts.
JPD also shows the identification of Interface Forming Residue (IFR) and
their internal contacts. JPD offers information about electrostatic potential
and curvature on protein surface. In addition, comparison of the Secondary
Structure annotated by PDB, by DSSP and by Stride is presented. (2002)
10.20.
Java Table of Contacts -- is a interactive tool for listing contacts
between residues of one protein and dividing them in specific classes. JTC
shows all contacts for a specified residue, IFR Contacts and also Protein-DNA
Contacts (the latter one starting from SMS version 3.1). This interactive
tool allows user to access other SMS components or have physical-chemical
parameters already "painted" within the table, such as: relative entropy,
accessibility, secondary structure and the distance for the identified contacts.
The user can make a choice of the residues important for his consideration,
make them appropriately displayed and then print the table of publication
quality. (2002)
10.21.
Protein DNA Contacts -- This SMS component demonstrates relevant
contacts being established across the interface formed by protein and DNA
chain. Similar logistics is used here as in IFR Graphical Contacts. (2003)
10.22.
SMS_P3 -- SMS_P3 sands for SMS Phylogenetic Tree component. Phylogenetic
tree is generated starting from either HSSP or SH2Qs multiple sequence alignments.
TreeView standard viewer package is used to present to a user calculated
phylogenetic trees. (2003)
10.23.
SMS 2.2 -- STING Millennium is a new Java-based WWW tool for the simultaneous
display of information about macromolecular structure (in STING Millennium
Graphics Window) and sequence (in STING Millennium Sequence Window). Includes
graphical amino acid Contacts, Ramachandran plot, Surfaces, Sequence neighbors
and other features. Parsing of data from relevant Data Bases (HSSP and SwissProt)
is one of the key features of this integrated environment for structure/function
analysis of the proteins, DNA and their complexes. To see the 3D structure
you need to download and install the CHIME plugin. (2003)
10.24.
Gold STING-- STING Millennium is a new Java-based WWW tool for the
simultaneous display of information about macromolecular structure (in STING
Millennium Graphics Window) and sequence (in STING Millennium Sequence Window).
Includes graphical amino acid Contacts, Ramachandran plot, Surfaces, Sequence
neighbors and other features. Parsing of data from relevant Data Bases (HSSP
and SwissProt) is one of the key features of this integrated environment
for structure/function analysis of the proteins, DNA and their complexes.
To see the 3D structure you need to download and install the CHIME plugin.
(2003)
10.25.
STING Report -- GOLD STING Report is a web based application for extracting
concise and focused information from the GOLD STING Data Base on specific
amino acids within the structures described in PDB files. The extracted
information is presented to a user through a series of GIF images and a
table of numerical values for the set of structure/function descriptors/parameters,
generated by the GOLD STING components. The resulting HTML page with the
GIF images and the table is ready to be printed and most importantly, it
can be visualize at platforms with the most elementary configurations (no
java, chime, plug-ins etc.). Below is a schematic view of GIF image panels
which are generally produced by the GOLD STING Report. We have used 1cho.pdb,
chain E, residue HIS_57 to generate GOLD STING Report for this help. Other
panels will be added with the time, making GOLD STING Report GIF image collection
more extensive. (2003)
10.26.
Diamond STING -- Diamond STING is a new version of the STING suite
of programs for comprehensive analysis of a relationship between protein
sequence, structure, function and stability. We have added number of new
functionalities by both providing more structure parameters to the STING
Database and by improving/expanding the interface for enhanced data handling.
The integration among the STING components has also been improved. A new
key feature is the ability of the STING server to handle local files containing
protein structures (either modeled or not yet deposited to the PDB) so that
they can be used by the principal STING components: JavaProtein Dossier
and STING Report. (2004)
10.27.
Multiple Structure - Single Parameter (MSSP) 2D Plot - The Multiple
Structures - Single Parameter 2D module allows the user to compare, in a
graphical manner, any one of the 150 different parameters in different protein
structures in a simple yet intuitive plot. The plot shows the numerical
values in the Y-axis and the sequence residue numbers in the X-axis. (2006)
10.28.
Contact Distance Map - Contact Distance Map (CDM) is a STING's
module. It is designed to display graphically all the protein's contacts.
Moreover, the Secondary Structure (SS) elements are also shown in a single
line, facilitating theirs visualization for each residue, and contour curves
distances maps involving a carbon, ß carbon and LHA-LHA (Least Heavy Atom)
are presented in a Java interactive interface. (2006)
10.29.
Protein Contacts Difference - In STING_PCD users can obtain a complete
comparison report of the intrachain interactions for any two chains described
in the PDB format file. The user must supply any two PDB ids and corresponding
chain ids for the analysis. At the output, a user will receive a list of
interactions which were preserved in both chains as well as the list of
those which are present in only one of them. Users can also analyze a wild
type protein and a corresponding mutant structure with a single point mutation;
in this case a user needs to supply at the input, the mutated amino acid
name and the number. (2006)
10.30.
Topology Similarity Map (TopSiMap) - STING_TopSiMap is a module
which makes possible to compare the contact maps of two chains in terms
of the preserved interactions as well as the ones which are present in only
one of the two chains analyzed. Users can see / print the images of the
maps and also view the contacts in a JMol window where STING presents two
structurally aligned chains. Users can also compare the chains in terms
of the contacts classification (hydrophobic, aromatic stacking, hydrogen
bonds, salt bridges and cysteine bridges) and corresponding energies. (2006)
10.31.
STING_DB QA - This module is designed for checking the
quality of STING_DB, the STING_DB Quality Assessment (STING_DB QA). With
this new module, a user can perform the tracking of the PDB files which
contains the insufficient information clarity for a specific structure descriptor
calculation. Also, the overall quality of the STING_DB is much easier to
assess now, setting this STING version apart from other products in this
area. (2006)
10.32.
STING_TGZ - STING_TGZ module generates a compressed file containing
all the files used by several STING's modules, for example, JPD (Java Protein
Dossier). These files are saved in different directories within the compressed
file. If your research project needs to analyze the same pdb file very often,
the best way to save time (in downloading data from internet) is to use
STING_TGZ module. (2006)
10.33.
3D Java Protein Interface Viewer - JPIV - JPIV is a module
of STING suite. It is designed to visualize and analyze the proteins' interfaces.
In order to accomplish this, the interfaces are displayed separately, and
over each one of them is painted a common physical-chemical property, available
from STING_DB, that could be important in the complex formation. The contact
interfaces are generated using weighted Delaunay triangulation and marching
tetrahedra algorithms from the CGAL library, afterwards they and rendered
in an Interactive Java Viewer based on JavaView library. (2006)
10.34.
PDB_Metrics - PDB Metrics can retrieve specific data from
the Protein Data Bank (PDB). It provides residues occurrences in the whole
PDB repository, keywords search, PDB sorted by file size, PDB sorted by
number of chains, PDB sorted by resolution of 3D data, protein families
classification, among other facilities. (2006)
10.35.
Star STING - Star STING is the February, 2006 version of the STING
suite of programs and corresponding database. Five important aspects of
this package that acquired some new characteristics, designed to add key
advantages to the whole suite: 1) Availability for most popular platforms
and browsers, 2) Introduction of the STING_DB quality assessment, 3) Improvement
in algorithms for calculation of three STING parameters, 4) Introduction
of five new STING modules, and 5) expansion of the existing modules.
The Star STING is freely accessible at: http://sms.cbi.cnptia.embrapa.br/SMS/
and http://trantor.bioc.columbia.edu/SMS. (2006)
10.36.
2-Dimensional Interface Maps - 2DIM - Designed to visualize separately
the protein interfaces and analyze the main forces involved in protein complex
formation. The 2DIM uses Floater's shape preserving algorithm to project
the 3D protein interfaces into 2D, where it is then possible to superimpose
the surfaces and estimate the interaction area between them. (2006)
10.37.
Sting Enzyme Classification - Module dealing with a protein classification
based on STING_DB parameters. (2006)
10.38.
Topologs 100 - In this module, users can obtain the index for a
topology similarity for a list of up to 100 structures. By submitting the
STING TGZ file (containing all STING_DB parameters, precalcualated, corresponding
to certain public or local structure) and a text file containing the list
of up to 99 public PDB files, user can start the procedure which calculates
the similarity index among selected (up to) 100 structures. This index is
a reliable measure of the changes in the pattern of the intrachain interactions
and can be used to analyze the topology similarities. (2006)
10.39.
Topologs Astral 40 - This is a database of homologous PDB chains
based on their interactions (contacts) pattern. For each of the "ASTRAL
40" ensemble chains, we computed a list of the most similar chains based
on their contact maps. The database is searchable and for each chain, the
list of the topologs is presented. (2006)
10.40.
Multiple Parameter Alignment 3D Plot - Deals with the presentation
of a single parameter for multiple structures or multiple parameters for
a singles structure. (2006)
10.41.
Amino Acid Co-evolution - The AA Co-evolution is the STING component
which permits a user to examine co-evolution parameter of residues in a
simple, yet intuitive 3D plot. A user may confirm which amino acid positions
were identified by STING, within the previously confirmed amino acid conserved
set, as evolved in concert. (2006)
10.42.
Protein Ligand Contacts - This STING module can
analyze the interatomic contacts in protein - ligand complexes. The contacts
shown by this STING module include those mediated by charge-charge interactions,
hydrogen bonds and hydrophobic contacts. (2006)
10.43.
BlueStar STING - BlueStar STING is the July,
2006 version of the STING suite of programs and corresponding database.
Five important aspects of this package that acquired some new characteristics,
designed to add key advantages to the whole suite: 1) Relational Database
of STING parameters, 2) Amino acid co-evolving residues identified, 3) protein
ligand contacts now available, 4) Sting Report now available in PDF format,
and 5) improved cross-talk among existing STING modules .
The BlueStar STING is freely accessible at: http://sms.cbi.cnptia.embrapa.br/SMS/
and http://trantor.bioc.columbia.edu/SMS. (2006)
10.44.
Java Secondary Structure Dossier (JSSD) - With
this STING module a user may visually and numerically observe and analyze
per residue reported structure descriptors for the SSE: alpha helices and
beta strands. (2007)
10.45.
Multiple Structure Single Parameter Alignment (MSSP)
- With this STING module a user may visually and numerically observe and
analyze per residue reported structure descriptors for the multiple structures
previously aligned (structurally). (2012)
10.46.
Rede Neutral para Dados de STING (RNDS) - With
this STING module a user can make use of the Neural Network for classifying
number of different Residues in different classes (such as IFR vs non IFR)
based on STING structure descriptors. (2012)
10.47.
Neural Network for Protein Protein Interface Identification
(USI-PePI) - With this STING module a user may visually and numerically
observe and analyze per residue reported structure descriptors for areas
classified as protein Interface and areas classified as Free Surface - areas
predicted using neural network. (2012)
10.48.
Linear Model for Protein Protein Interface Prediction
(LM_IFR_STING) - With this STING module a user may visually and
numerically observe and analyze per residue reported structure descriptors
for areas classified as protein Interface and areas classified as Free Surface
- areas predicted using linear model. (2012)
10.49.
STING_MSSP: Multiple structure single parameter
http://www.cbi.cnptia.embrapa.br/SMS/STINGm/MPA/index.html
(2016)
10.50.
Protein Specificity Analysis by STING - PsaS
http://www.cbi.cnptia.embrapa.br/SMS/STINGm/psas/overview.html
(2016)
10.51.
EPI- Peptide Designer
http://www.biocomp.icb.ufmg.br/biocomp/?page_id=201
(2016)
2005
11.8.1.
"Ferramentas da Bioinformática Estrutural". Centro Nacional de Pesquisa Tecnológica em Informáticapara a Agricultura - CNPTIA. Campinas, Brazil.
11.8.2.
"Proteoma e Recursos da Bioinformática". Centro Nacional de Pesquisa Tecnológica em Informáticapara a Agricultura - CNPTIA. Campinas, Brazil. April.
11.8.3.
"O que os 306 descritores de estrutura e função do STING_DB poderiam ensinar sobre a relação entre a sequência/estrutura/função das proteínas". Doutorado Bioinformática Universidade Federal de Minas Gerais. Belo Horizonte, Brazil. June.
11.8.4.
"ISMB 2006 to be held in Fortaleza, Ceara, Brazil". ISMB 2005. Detroit, USA. June.
11.8.5.
"STING - A Web Server for Comprehensive Analysis of Protein Structure and Sequence". ISMB 2005. Detroit, USA. June.
11.8.6.
"The Identification of the Folding Essential Residues and Active Site Residues by looking at an extensive DB of the Structure Descriptors in Diamond STING". Beckman Institute, University of Illinois. Urbana-Champaign, USA. July.
11.8.7.
"The identification of the folding essential residues and active site residues by looking at an extensive DB of the structure descriptors in Diamond STING". Department of Biochemistry and Molecular Biophysics, Columbia University, USA. July.
11.8.8.
"The Identification of the Folding Essential Residues and Active Site Residues by looking at an extensive DB of the Structure Descriptors in Diamond STING".Beckman Institute for Advanced Science and Technology. USA. June.
11.8.9.
"Como a bioinformática pode impulsionar o campo de saúde". Instituto de Pesquisa e Desenvolvimento da UNIVAP. São José dos Campos, Brazil. September.
11.8.10.
"How high performance computing can drive agriculture and health realted research". II Fórum de Tecnologia e Aplicações de Sistemas de Alto Desempenho. Rio de Janeiro, Brazil. October.
11.8.11.
"Diamond STING". NANOGEN - II Workshop de Nanotecnologia Aplicada às Ciências Biológicas e Genética. Universidade Estadual do Ceará. December.
2006
11.9.1.
"Bioinformatics (Computational Biology) at Embrapa: 1989-2006 and beyond". Centro Nacional de Pesquisa Tecnológica em Informáticapara a Agricultura - CNPTIA. Campinas, Brazil.
11.9.2.
"Studying the amino acid co-evolution in terms of protein stability and functionality". Segundas Jornadas Iberoamericanas de Bioinformatica, Buenos Aires, December, 2-5 , Buenos Aires, Argentina.
2007
11.10.1.
"Computational Biology and Bioinformatics". 6. Congresso Brasileiro de Agroinformática - SBIAgro 2007São Paulo, Brazil.
11.10.2.
"Protein Folding Seen Through the Secondary Structure Element Dossier and Chameleon Sequences". 2d Latin American Protein Society Meeting (2LAPSM), Acapulco, Mexico.
2008
11.12.1. "The architecture of Proteins, nano and macro Engines and of the Software".
- Regional Architect Forum 2008, Microsoft Brazil, São Paulo, Brazil.11.12.2.“The Table of Interface Forming Residues as the Specificity Indicator for Serine Proteases Bound to Different Inhibitors “ BIOCOMP 2008, Las Vegas, NE, (July 2008) USA
11.12.3. “Dossier of Secondary Structure Elemnts Amino Acid Properties “
ISMB 2008, Toronto, (July, 2008) Canda
11.12.4. “Contact coordination patterns and electrostatic potential at alpha carbon atoms: a dossier of protein secondary structure elements“ Embnet 2008, Bari,(Sptember, 2008) Italia
11.12.5. ““Embnet activities at the Campinas Node, SP – Brazil“ Embnet 2008, Bari,(Sptember, 2008) Italia
11.12.6“Structure Descriptors of Chameleon Sequences “ RIB 2008, Santiago de Chile (October 2008), Chile
11.12.7 “How did the structure function descriptors of proteins change with introduction of “remediated” pdb files - large scale db maintanance“ RIB 2008, Santiago de Chile (October 2008), Chile
2010
11.13.1. "Protein structure descriptors and prediction of macromolecular interfaces and catalytic site residues".
- European Bioinformatics Institute (EBI), Cambridge, England.11.13.2. "Protein structure descriptors and prediction of macromolecular interfaces and catalytic site residues".
- Universidade de Cambridge, Cambridge, England.11.13.3. "Protein structure descriptors and prediction of macromolecular interfaces and catalytic site residues".
- UNIFESP, São Paulo, Brazil.11.13.4. "Biologia computacional estrutural oferece as ferramentas e o conhecimento para ampliar a participação da Embrapa Informática Agropecuária em produção de Inovações Tecnologicas e em prol da agricultura Brsileira".
- Embrapa Informática Agropecuária, Campinas, Brazil.
2011
11.14.1. "Protein structure descriptorsfrom STING platform used for analysis of structure/function relationship in proteins",
February 28 - March 4, 2011, ESPCA-Advanced Topics in Human Molecular Genetics,
Universidade Estadual de Campinas and Embrapa Agricultural Informatics, Campinas, SP, Brazil
2012
11.15.1. "Computational Biology and Docking- Development of new Drugs",
March 21, 2012,
UNIFESP, São Paulo, Brasil11.15.2. "Using Blue Star STING latform for Analysis of Protein structure / function relationship: Designing Drugs and Agrochemicals to fit new protein targets for bacterial, fungal and insect control",
April 02, 2012, ESPCA-Advanced Topics in Computational Biology: Agrochemical and Drug Design,
Embrapa Agricultural Informatics and Universidade Estadual de Campinas, Campinas, SP, Brazil11.15.3. "Prediction, Analysis and Characterization of Therapeutic Targets for Proteins Found in PhitoPathogenic Organisms and Applications for Agrichemical and Drug Design",
May 22, 2012, Sociedade Brasileira de Bioquimica e Biologia Molecular - SBBq, XLI Annual Meeting
Foz de Iguaçu, PA, Brazil11.15.4. "Using Blue Star STING latform for Analysis of Protein structure / function relationship: Designing Agrochemicals to fit new protein targets for bacterial, fungal and insect control",
August 23, 2012, Centro de Biologia Molecular e Engenharia Genetica,
Universidade Estadual de Campinas, Campinas, SP, Brazil11.15.5. "Using Blue Star STING latform for Analysis of Protein structure / function relationship: Designing Agrochemicals to fit new protein targets for bacterial, fungal and insect control",
November 20, 2012,
Universidade Federal de Minas Gerais, Belo Horizonte, MG, Brazil
2013
11.16.1. "Computational biology breakthrough – unifying data and hypothesis driven research",
My 23, 2013,
UNICAMP, Campinas, SP, Brasil11.16.2. "Importancia de abordagem de estatística em descoberta dos novos fármacos",
June 17, 2013
Universidade Federal Rural de Pernambuco,Recife, PE, Brazil11.16.3. "Using structural and physicochemical parameters to identify functional districts in proteins - the imortance of electrostatic potential ",
July 03, 2013
Instituto Italiano Di Tecnologia, Genova, Italy.11.16.4. "Using structural and physical-chemical parameters to identify diverse functional districts in proteins",
November01, 2013
Department of Biochemistry, University of Oxford, England.11.16.5. "Using structural and physical-chemical parameters to identify diverse functional districts in proteins",
November01, 2013
Structural Genomics Consortium, Nuffield Department of Clinical Medicine, University of Oxford, England.
2014
11.17.1. "Using structural and physical-chemical parameters to identify diverse functional districts in proteins",
September 02, 2015,
at: “2ª Escola de Biofísica Molecular: Ressonância Magnética Nuclear (RMN) aplicada à biofísica das moléculas da vida: uma abordagem experimental, teórica e computacional”
UNESP, São José do Rio Preto, SP, Brasil2015
11.18.1. "Using structural and physical-chemical parameters to identify diverse functional districts in proteins: applications in drug design",
August 21, 2015,
(90 min duration)
USP, Ribeirão Preto, SP, Brasil
201611.19.1. “Using structural and physical-chemical parameters to identify functional districts in proteins - case study: protein interfaces”,
May 03, 2016,
(90 min duration)
Molecular Biophysics, Department of Systems Biology and Department od Medical Sciences in Medicine, Columbia University, New York City, NY, USA
12. COURSES
This Section Updated: June 08, 201712.1.
"Drug design and structural Bioinformatics", 29 January - 08 February / 04 March - 08 March 2002, Centro Nacional de Pesquisa Tecnológica em Informática para a Agropecuária CNPTIA, Campinas, SP, Brazil.
12.2.
"Fisrt Sting Millennium Suite (SMS): tools to Analyze Macromolecular Structures and Applications in Chemogenomics", 29 - 30 October 2002, Centro Nacional de Pesquisa Tecnológica em Informática para a Agropecuária CNPTIA,
Campinas, SP, Brazil.
12.3.
"Bioinformática Estrutural", 07 - 17 April 2003, Centro Nacional de Pesquisa Tecnológica em Informática para a Agropecuária CNPTIA,
Campinas, SP, Brazil.
12.4.
"Pan American Advanced Studies Institute - Knowledge Discovery in Genomic Databases"; 07 - 17 February 2004, Biotec Plaza Zona America;
Montevideo Uruguay.
12.5.
"WORKSHOP INTERNACIONAL DE NANOTECNOLOGIA APLICADA ÀS CIÊNCIAS BIOLÓGICAS E GENÉTICA" June 2004, FVA/CNPq;
Fortaleza -Ceara, Brazil.
12.6.
"BIOINFORMÁTICA APLICADA À PROTEÔMICA".Septemeber - 2004, LNCC -
Petropolis - Brazil.
12.7.
"Algorithms and Computational Methods for Biochemical and Evolutionary Networks (CompBioNets'04)". December - 2004. Universidade de Pernanbuco,
Recife - Brazil;
12.8.
"Diamond STING: suite of software for comprehensive protein structure/stability/function analysis" {80 hours} March 2005,
La PLata - Argentina.
12.9.
"Bioinformática Estrutural - NG250A", August/September 2005, Centro Nacional de Pesquisa Tecnológica em Informática para a Agropecuária CNPTIA,
Campinas, SP, Brazil.
12.10.
"Structural Bioinformatics" - {80 hours} September 2006, Embrapa Informatica Agropecuaria, Embrapa Bioinformatics Network,
Campinas, SP, Brazil.
12.11.
"Structural Computational Biology - using STING_DB to study protein structures " - {80 hours} February 2008, Embrapa Informatica Agropecuaria,
Campinas, SP, Brazil.12.12.
"Structural Bioinformatics" - {120 hours} October/November 2008, Embrapa Informatica Agropecuaria and UNICAMP,
Campinas, SP, Brazil.12.13.
"Structural Bioinformatics" - {80 hours} October 2009, Embrapa Informatica Agropecuaria and UNICAMP,
Campinas, SP, Brazil.12.14.
"International Course on Analysis of Macromolecular Structures" - {60 hours} June 21- July 01, 2010, Centro Nacional de Biotecnologia,
Madrid, Spain.12.15.
"Pratical Course in Computational Biology " - {12 hours} February 28 - March 4, 2011, ESPCA-Advanced Topics in Human Molecular Genetics,
Universidade Estadual de Campinas and Embrapa Agricultural Informatics, Campinas, SP, Brazil12.16.
"Pratical Course in Computational Biology " - {8 hours} April 01-07, 2012, ESPCA: Advanced Topics in Computational Biology - Agrochemical and Drug Design,
Embrapa Agricultural Informatics and Universidade Estadual de Campinas,
Campinas, SP, Brazil12.17.
"Structural Bioinformatics" - {120 hours} October 31- December 07, 2012, Embrapa Agricultural Informatics and Universidade Estadual de Campinas,
Campinas, SP, Brazil12.18.
"Uso de STING e do seu banco de dados para mineração de informação" - {5 hours} April 20, 2013, UFMG, Instituto de Ciências Biologicas, Belo Horizonte, MG, Brazil.
12.19.
"STING Platform for protein structure-function analysis"- {10 hours} May 14, 2013, EMBnet AGM Workshop: "NGS and Structural Biology", Valencia, Spain.12.20.
"From NGS data through the third dimension towards new agrochemicals and drugs"- {10 hours} May 29-30, 2014, EMBnet AGM Workshop, Lyon, France.12.21.
"Aplied Bioinformatics"- {8 hours} May 06, 2014, part of the IQ course: QP320: Advanced Biotecnology and Biochemistry. UNICAMP, Campinas, SP, Brazil.12.22.
"Structural Computational BIology - Agrochemical and Drug design" - {105 hours} October 01- November 07, 2014, Embrapa Agricultural Informatics and Universidade Estadual de Campinas - UNICAMP, Campinas, SP, Brazil12.23.
"Computational BIology - Applications in Agrochemical and Drug design" - {60 hours} December 07, 2015, Embrapa Agricultural Informatics and Universidade Estadual de Campinas - USP Riberão Preto and UFSCAR São Carlos, SP, Brazil12.24.
"Structural Computational BIology - Agrochemical and Drug design" - {60 hours} June 06- 15, 2016, Embrapa Agricultural Informatics and Universidade Estadual de Campinas - UNICAMP, Campinas, SP, Brazil
13. Projects
This Section Updated: June 08, 2017
Year Supporting Agency US$ R$ Project title 1 1990 IICA 120.000,00 Computer Modelling and visualisation 2 1994 FAPDF - 210.000,00 Bioinformatics in service of molecular biology and biotechnology 3 1994 SGI 30.000,00 - Computational Structural Biology in service of agro-business 4 1997/8 NSF 50.000,00 - Sequente To and withIN Graphics - STING 5 198/9 FAPDF 100.000,00 - Computer visualisation of quarantene pests 6 2001 FAPSP 285.741,10 185.731,72 Structural BioInformatics Research and Service Center (CBI) 7 2001 CNPq - 240.000,00 Bioinformatics: From Gene Annotation to Development of Drugs - Implementation of new Computational Tools, Proprietary Data Banks and Metacomputing Concept 8 2002 FINEP - 381.444,16 Structural Bioinformatics Applications with high demand for available CPU time in post-genomic era 9 2002 CNPq - 55.581,26 Expanding STING_DB 10 2004 SUN Computers 150.000,00 - STING_RDB 11 2006 FAPSP - 80.000,00 ISMB 2006 and X-meeting 2006 support 12 2007 SUN Computers 150.000,00 - GenoProt PLUS - pipline for deciphering function of proteins identified by Brazilian genomes projects13 2007 Embrapa- MP1 - (2.300.000,00) Co-participation: Functional Foods and Nutrigenomics - Computational Biology - structure analysis14 2008 CNPq (55.000,00) Co-participation: Nanotecnology Impacts15 2008 CENAPAD - - STING_DB update16 2008 FAPBA - -Catalisadores e processos enzimáticos para produção de biodiesel 17 2010 FAPESP 16.280,06 73.034,62 Aplicação de técnicas de reconhecimento de padrões usando os descritores estruturais de proteínas da base de dados do software STING para discriminação do sítio catalítico de enzimas18 2012 Embrapa - -Estudos de comunicação entre as macromoléculas em homo e hetero-complexos através das suas interfaces 19 2012 Embrapa - -Uso os descritores estruturais de proteínas da STING_DB para clasificação do sítio catalítico de enzimas 20 2012 FAPESP 19.500,00 498.300,00ESPCA-Computational BIology: Agrochemical and Drug Design 21 2012 Embrapa - 697.101,00Renovação do parque computacional de Grupo de Pesquisa em Biologia Computacional (GPBC) com aquisição da plataforma Accelrys for HTS 22 2014 Embrapa - 226.000,00Ampliação de capacidade computacional dos servidores GPBC (granted but not yet available) 23 215 Fapesp - 67.386,93Ranking optimization of small organic compounds in virtual screening campaigns using physical-chemical and structural descriptors of the protein-ligand interaction nano-environment 24 2016 Embrapa - -Otimização do ranqueamento de pequenos compostos orgânicos em campanhas de triagem virtual usando atributos físico-químicos e estruturais do nanoambiente de interação proteína-ligante US$ R$ Total 27 years total 921.521,16 2.488.579,69 Total received funds from November of 1988 until end of December of 2014 is about: US$ 2.2M or US$84.6K/year Per Year 34.130,41 92.169,62 My research was able to contract each year (in average over the 26 year period: since November of 1988):
approximatelly_____US$.35.000,00 and R$93.000,00 Per publication 109 published
items 8.454,32 22.831,01 Average cost of my 54 publications + 4 patents + 51 software packages (total of 109 items) is:
US$8,946.81 and R$23.500 or total of approximately US$16.704,80/published item (*)Values are cited for the date received (consequently should be indexed for both currency fluctuations)
(*) Both values for the number of published items and the amount of financial support gained during certain period, are debatable issues in terms of simplistic algorithm used here to present some kind of average cost per published item and consequently may be further discussed, expanded and/or improoved. The important point is to use some kind of normalization for productivity measures, which is almost never done today in most of the cases. It is important to notice that I am not including in my production other scientific elements, such as the orientation of students for their thesis work, oral presentation at congresses, seminars and courses, course organization, regular classes, project evaluation, paper evaluation and many others. If I would do so, than the per item produced value would be much lower than the one presented above;
Type of scientific production Number of units 1 Papers and Book chapters 54 2 Work Presened at Scientific Meetings 123 3 Thesis Oriented 25 4 Seminars 103 5 Softwares 51 6 Curses 24 7 Projects 24 8 Technical Documents 20 9 Patents 4 10 Awards 8 TOTAL 436Average cost of all types of my TOTAL scientific Production (total of 436items) is
(921.521,16+758.697,07)= 1.680.218,23USD:
US$3.853,71/ item delivered (US$1.680.218,23 on June 08, 2017 total funds acquired)
14. PATENTS
This Section Updated: February 18, 201614.1.
Neshich, Goran ; Neshich, Izabella AP ; Nishimura Leticia ; SALIM, J. A. ; MAZONI, Ivan ; JARDINE, José G. ; NESHICH, G .
" IDENTIFICAÇÃO DE ALVOS TERAPÊUTICOS PARA DESENHO COMPUTACIONAL DE DROGAS CONTRA BACTÉRIAS DOTADAS DA PROTEÍNA PILT".
2010, Brasil.
Patente: Privilégio de Inovação. Número do registro: PI1089068, data de depósito: 28/10/2010,
título: "IDENTIFICAÇÃO DE ALVOS TERAPÊUTICOS PARA DESENHO COMPUTACIONAL DE DROGAS CONTRA BACTÉRIAS DOTADAS DA PROTEÍNA PILT" ,
Instituição de registro:INPI - Instituto Nacional da Propriedade Industrial. Instituição(ões) financiadora(s): EMBRAPA14.2.
NESHICH, G ; Neshich, Izabella AP ; MAZONI, Ivan ; JARDINE, Jose Gilberto ; SALIM, J. A. ; MORAES, F. R. .
" MÉTODO PARA PREVISÃO DE MUTANTES QUE AUMENTEM O ÍNDICE DE HIDROFOBICIDADE DA SUPERFÍCIE DE PROTEÍNAS".
2011, Brasil.
Patente: Privilégio de Inovação. Número do registro: PI1211604, data de depósito: 04/08/2011,
título: "MÉTODO PARA PREVISÃO DE MUTANTES QUE AUMENTEM O ÍNDICE DE HIDROFOBICIDADE DA SUPERFÍCIE DE PROTEÍNAS" ,
Instituição de registro:INPI - Instituto Nacional da Propriedade Industrial.
14.3.
NESHICH, G ; JARDINE, Jose Gilberto ; MAZONI, Ivan ; Izabella Pena ; NISHIMURA, L. .
INIBIDORES DAS ENZIMAS POLIGALACTURONASES DE FUNGOS FITOPATOGÊNICOS.
2012, Brasil.
Patente: Privilégio de Inovação. Número do registro: PI0003145, data de depósito: 02/02/2012,
título: "INIBIDORES DAS ENZIMAS POLIGALACTURONASES DE FUNGOS FITOPATOGÊNICOS" ,
Instituição de registro:INPI - Instituto Nacional da Propriedade Industrial.
14.4.
NESHICH, G ; JARDINE, J. G. ; MAZONI, I. ; NESHICH, I. A. P. ; NISHIMORI, L. .
" DESENHO COMPUTACIONAL PARA NOVOS INIBIDORES DE ALFA-AMILASES".
2012, Brasil.
Patente: Privilégio de Inovação. Número do registro: PI0003126, data de depósito: 09/05/2012,
título: "DESENHO COMPUTACIONAL PARA NOVOS INIBIDORES DE ALFA-AMILASES" ,
Instituição de registro:INPI - Instituto Nacional da Propriedade Industrial.
15. TECHNICAL ANNOUNCEMENTS
This Section Updated: February 18, 201615.1.
Utilização do Software GRASP para gerar Arquivo de Coordenadas com Valores de Potencial Eletrostático
Paula Kuser Falcão / Christian Baudet / Adauto Luiz Mancini / Roberto Hiroshi Higa / Goran Neshich
November 2002 / Campinas, SP15.2.
Experiência de utilização do XML no SMS.
Roberto Hiroshi Higa / Christian Baudet / Esther Manoela de Freitas / Gabriela Felix dos Santos / Adauto Luiz Mancini / Paula Kuser Falcão / Goran Neshich
December 2002 / Campinas, SP15.3.
Incorporação das Propriedades Rotâmeros e Ocupância em Métodos de Análise Estrutural de Proteínas.
Paula Kuser Falcão / Christian Baudet / Roberto Hiroshi Higa / Goran Neshich
December 2002 / Campinas, SP15.4.
Calculo de Área acessivel por Solvente Utilizando SURFV - Definição de Interface Intramolecular pelo SMS.
Roberto Hiroshi Higa / Adauto Luiz Mancini / Paula Kuser Falcão / Goran Neshich
December 2002 / Campinas, SP15.5.
Análise do Grau de Conservação de Residuos em Proteínas com Estrutura 3D Resolvida Utilizando o SMS.
Roberto Hiroshi Higa / Christian Baudet / Adauto Luiz Mancini / Paula Kuser Falcão / Goran Neshich
December 2002 / Campinas, SP15.6.
Curvatura da Superfície de Proteínas no Java Protein Dossier.
Paula Kuser Falcão / Christian Baudet / Roberto Hiroshi Higa / Goran Neshich
December 2002 / Campinas, SP15.7.
SMSLib - Biblioteca C++ do Sting Milleinnium Suite.
Roberto Hiroshi Higa / Christian Baudet / Adauto Luiz Mancini / Amanda Remmez Mattiuz / Esther Manoela de Freitas / Paula Kuser Falcão / Goran Neshich
December 2002 / Campinas, SP15.8.
Apresentação Gráfica de Parâmetros Protéicos Utilizando o Java Protein Dossier.
Roberto Hiroshi Higa / Christian Baudet / Paula Kuser Falcão / Adauto Luiz Mancini / Goran Neshich
December 2002 / Campinas, SP15.9.
Estudo da Influência de Sequências Polipeptídicas e de Códons na Determinação de Estrutura Secundária de Proteínas.
Goran Neshich / Jair Lage de Siqueira Neto
December 2002 / Campinas, SP15.10.
Determinação da Estrutura e Estudo da Função da Metalotionéina de Synechococcus com Ferramentas da Bioinformática.
Goran Neshich / Andréa Guelfi / Silvia Maria Guerra Molina
December 2002 / Campinas, SP15.11.
Utilização de Alinhamento Estrutural de Proteínas no Estudo de Interface Forming Residues de Proteína-quinases com Inibidores Proteicos.
Jorge Hernandez Fernandez / Goran Neshich
December 2002 / Campinas, SP
15.12.
Análise Preliminar de um Processo para Identificação e Alinhamento de Sequências Homólogas para Proteínas com Estrutura Resolvida.
Roberto Hiroshi Higa / Paula Kuser Falcão / Michel Eduardo Beleza Yamagishi / Adauto Luiz Mancini / Goran Neshich
September 2003 / Campinas, SP15.13.
Cálculos de Possíveis Contatos Atômicos Internos a uma Proteína ou entre Proteínas no Software SMS.
Adauto Luiz Mancini / Roberto Hiroshi Higa / Paula Kuser Falcão / Michel Eduardo Beleza Yamagishi / Goran Neshich
December 2003 / Campinas, SP15.14.
Grau de Conservação de Aminoácidos de Proteínas: Comparação entre Entropia Relativa e Pressão Evolucionária
Roberto Hiroshi Higa / Paula Regina Kuser Falcão / Michel Eduardo Beleza Yamagishi / Maria Fernanda Moura / Renato Fileto / Adauto Luiz Mancini / Goran Neshich
October 2004 / Campinas, SP15.15.
Modelagem molecular da proteína small heat shock de Xylella fastidiosa
Paula Regina Kuser Falcão / Susely Ferraz de Siqueira Tada / Anete Pereira Souza / Michel Eduardo Beleza Yamagishi / Adauto Luiz Mancini / Renato Fileto / Roberto Hiroshi Higa / Goran Neshich
December 2004 / Campinas, SP
15.16.
Identificando Pockets na Superfícia Protéica usando o Java Protein Dossier - JPD
Michel Eduardo Beleza Yamagishi / Paula Regina Kuser Falcão / Roberto Hiroshi Higa / Edgard Henrique dos Santos / José Gilberto Jardine / Ivan Mazoni / Stanley Robson de Medeiros Oliveira / Adauto Luiz Mancini / Goran Neshich
August 2005 / Campinas, SP15.17.
Rotâmeros Raros no Java Protein Dossier
Michel Eduardo Beleza Yamagishi / Paula Regina Kuser Falcão / Stanley Robson de Medeiros Oliveira / Roberto Hiroshi Higa / Edgard Henrique dos Santos / Ivan Mazoni / Fábio Danilo Vieira / Adauto Luiz Mancini / Goran Neshich
November 2006 / Campinas, SP15.18.
Aspectos Computacionais da Análise da Co-evolução de Aminoácidos que pertencem a uma Proteína qualquer
Marcelo Gonçalves Narciso / Michel Eduardo Beleza Yamagishi / Thiago Quinaglia / Edgard Henrique dos Santos / Fábio Danilo Vieira / José Gilberto Jardine / Ivan Mazoni / Paula Regina Kuser Falcão / Goran Neshich
November 2006 / Campinas, SP15.19.
Projeções de Superfície 3D no Plano para Análise de Interfaces Proteicas através do Sting
Marcelo Gonçalves Narciso / Michel Eduardo Beleza Yamagishi / Thiago Quinaglia / Edgard Henrique dos Santos / Fábio Danilo Vieira / José Gilberto Jardine / Ivan Mazoni / Paula Regina Kuser Falcão / Goran Neshich
December 2006 / Campinas, SP15.20.
VPRO - Um Identificador de Padrões de Seqüências
Edgard Henrique dos Santos / Paula Regina Kuser Falcão / Goran Neshich
July 2007 / Campinas, SP
16. AWARDS
This Section Updated: February 18, 201616.1.
ISCB Board of Directors, Director, International Society for Computational Biology. 200216.2.
Premiacao EMBRAPA Inforamtica Agropecuaria, Sistema EMBRAPA : CNPTIA. 200216.3.
Premiação Nacional do sistema EMBRAPA na categoria Qualidade Tecnica, EMBRAPA. 200416.4.
Premio por excelência EMBRAPA, EMBRAPA. 200516.5.
Profesor Visitante ad Honorem, Universidad Nacional de La PLatta, Faculdad de Ciencias Exactas, Argentina. 200516.6.
Certificate of Appreciation for the Exceptional Service to the Society (ISCB), International Society of Computational Biology. 200616.7.
Honorable mention for best posters in Structural Bioinformatics area. "Xylella fastidiosa HEXAMERIC PILUS RETRACTION MOTOR PILT INTERFACES ARE MAINTAINED BY NON-HYDROPHOBIC CONTACTS", X-Meeting 2009, Brazilian Association for Bioinformatics and Computational Biology (AB3C). 200916.8.
SBBq Award - Best Poster, XL Annual Meeting of The Brazilian of Biochemistry and Molecular Biology Society (SBBq), Brazilian of Biochemistry and Molecular Biology Society (SBBq). 2011
17. PROFESSIONAL REFERENCES
This Section Updated: February 18, 201617.1.
Antony Crofts, Professor and Head, The School of Molecular and Cellular Biology, at the University of Illinois at Urbana-Champaign 524 Burrill Hall, 407 S. Goodwin Avenue, Urbana, Il, 61801 USA
phone: (217) 333-2043
e-mail:Crofts@pop.life.uiuc.edu
or: a-crofts@uiuc.edu
http://www.life.uiuc.edu/~crofts17.2.
Colin Wraight, (1945-2014) {Associate Professor}, The School of Molecular and Cellular Biology, at the University of Illinois at Urbana-Champaign {524 Burrill Hall, 407 S. Goodwin Avenue, Urbana, Il, 61801USA}
{phone: (217) 333-3245}
{e-mail: cwraight@pop.life.uiuc.edu}17.3.
Eduardo Tadao Takahashi, Coordenador - Geral Adjunto, Rede Nacional de Pesquisa, CNPq/SCT - PR, Rua Dr. Antonio Augusto de Almeida, 334, Cidade Universitária, CEP 13083 CAMPINAS/SP - Brazil.
phone: +55 192 39.4141
fax: +55 192 39.3070
e-Mail: tadao@na-cp.rnp.br17.4.
Barry Honig, Professor, Dept of Biochemistry & Molecular Biophysics - Columbia University, New York , USA
phone: (212) 305-7970
fax: (212) 305-6926
e-Mail: honig@bass.bioc.columbia.edu
or: bh6@columbia.edu