Lectures
I.I. Vaisman, A. Tropsha, W. Zheng Compositional Preferences
in Quadruplets of Nearest Neighbor Residues in Protein Structures.
DIMACS
Workshop on Combinatorial Clustering and Multi-Domain Protein Structure
Analysis, Rutgers University, New Brunswick, NJ, 1998
I.I. Vaisman, A. Tropsha, W. Zheng Tessellated Molecules:
Computational Geometry of Chemical and Biological Structure. Second
CGC Workshop on Computational Geometry, Duke University, Durham,
NC, 1997
I.I.Vaisman, A.Tropsha, W.Zheng Computational geometry
of protein structure. Voronoi Workshop, Arizona State
University, Tempe, AR, 1997
I.I.Vaisman, A.Tropsha, W.Zheng Computational geometry
of molecular structure. 212 ACS National Meeting, Orlando,
FL, 1996
I.I.Vaisman Virtual laboratories in chemical research and education.212
ACS National Meeting, Orlando, FL, 1996
I.I.Vaisman, A.Tropsha, W.Zheng Computational geometry of molecular
structure. 4th WATOC Congress, Jerusalem, Israel, 1996
I.I.Vaisman Virtual communities at interdisciplinary boundaries.210
ACS National Meeting, Chicago, IL, 1995
I.I.Vaisman On-line chemistry: computer-mediated communication,
research and education. XIth International Conference on Computers
in Chemical Research and Education, Paris, France, 1995.
I.I.Vaisman Computer-mediated communication in science. AAAS-ABA
Invitational Conference on Legal, Ethical, and Technological Aspects
of Computer and Network Use and Abuse, Queenstown, MD, 1994
I.I.Vaisman Scientific information and computer networks.
Scientific Computing & Automation Conference: The Summit for
Scientific Computing, Washington, DC, 1993.
Posters
O. Shats, I.I. Vaisman, A. Rubinstein, and S. Sherman Sequence-Conformation-Structure
Database (SECOST) for Amino Acid Residues in Proteins: New Release.
Sixth Electronic Computational Chemistry Conference (ECCC6),
http://www.chemie.uni-regensburg.de/ECCC6, 1999
I.I.Vaisman, A.Tropsha, W.Zheng Computational geometry of molecular
structure. Frontiers in Chemistry: Molecular Basis of
the Life Sciences, 37th IUPAC Congress, Berlin, Germany, 1999
I.I.Vaisman Protein Structure Comparison Using Computational
Geometry Methods. Seventh International Conference on Intelligent
Systems for Molecular Biology, Heidelberg, Germany, 1999
O.Shats, I.I.Vaisman, A.Shats, S.Sherman Conformational Database
for Amino Acid Residues in Protein Structures. Fifth Electronic
Computational Chemistry Conference (ECCC5), http://hackberry.chem.niu.edu/ECCC5,
1998
I.I.Vaisman, A.Tropsha, W.Zheng Statistical geometry of
four-residue clusters in protein structures. Sixth International
Conference on Intelligent Systems for Molecular Biology,
Montreal, Canada, 1998
I.I.Vaisman, A.Tropsha, W.Zheng Statistical geometry of four-residue
clusters in protein structures. Second International
Conference on Computational Molecular Biology - RECOMB'98, New
York, NY, 1998
I.I.Vaisman Computational geometry of protein structure.
Pharmaceutical Research and Manufacturers of America Foundation
Annual Awardee Meeting, Washington, DC, 1998
I.I.Vaisman, A.Tropsha, W.Zheng Computational geometry of protein
structureInternational Conference on Bioinformatics: Gene Discovery
in silico, Atlanta, GA, 1997
I.I.Vaisman, A.Tropsha, W.Zheng Computational geometry
of protein structure.First International Conference on Computational
Molecular Biology - RECOMB'97, Santa Fe, NM, 1997
A.Tropsha, I.I.Vaisman, S.J.Cho, W.Zheng A new approach
to protein fold recognition based on Delaunay tessellation of protein
structure. 212 ACS National Meeting, Orlando, FL, 1996
I.I.Vaisman Virtual communities and network collaboration in
chemistry. 4th WATOC Congress, Jerusalem, Israel, 1996
I.I.Vaisman, W.Zheng , R.K.Singh, A.Tropsha, Statistical geometry
of molecular structure: Nonrandom Clustering of Amino Acid Residues.
International Conference on Protein Folding and Design, Bethesda,
MD, 1996
A.Tropsha, W.Zheng, I.I.Vaisman A new approach to sequence-structure
threading based on Delaunay tessellation of protein structure
International Conference on Protein Folding and Design, Bethesda,
MD, 1996
I.I.Vaisman Molecular informatics and World Wide Web 210
ACS National Meeting, Chicago, IL, 1995
I.I.Vaisman, D.Hoffman, R.K.Singh, A.Tropsha Statistical Geometry
of Protein Structure Intelligent Systems in Molecular Biology:
ISMB-95, Cambridge, UK, 1995
I.I.Vaisman, D.Hoffman, R.K.Singh, A.Tropsha Statistical Geometry
of Protein Structure: Patterns of Spatial Propensity of Amino Acid
Residues. Proteins Gordon Conference, Tilton, NH, 1995.
I.I.Vaisman Scientific communication in chemistry in the Internet
era. 208 ACS National Meeting, Washington, DC, 1994
I.I.Vaisman, F.K.Brown, A.Tropsha Differences in water structure
around hydrophobic and hydrophilic groups of a peptide. 208
ACS National Meeting, Washington, DC, 1994
I.I.Vaisman, A.Tropsha Statistical geometry of water structure
around solutes. Water and Aqueous Solutions - Gordon Research
Conference, Plymouth, NH, 1994
I.I.Vaisman Flooding the Superhighway: Water science and computer
networks. Water and Aqueous Solutions - Gordon Research Conference,
Plymouth, NH, 1994
I.I.Vaisman On-line proteins: computer networks and molecular
databases. Proteins Gordon Conference, Tilton, NH, 1993.
I.I.Vaisman, A.Tropsha Molecular simulation of tuftsin. Proteins
Gordon Conference, Tilton, NH, 1993.
I.I.Vaisman, L.Perera, M.L.Berkowitz Mobility of stretched water.
206 ACS National Meeting, Chicago, IL, 1993, Abstracts, COMP-14.
F.K.Brown, P.Charifson, R.Unwalla, A.Tropsha, I.I.Vaisman The
role of water in drug design. 205 ACS National Meeting,
Denver, CO, 1993, Abstracts, COMP-6.
I.I.Vaisman, L.Perera, M.L.Berkowitz Mobility of stretched water.
Water and Aqueous Solutions - Gordon Research Conference, Plymouth,
NH, 1992
I.I.Vaisman, M.L.Berkowitz Local structural order and molecular
associations in water-DMSO mixtures. Water and Aqueous Solutions
- Gordon Research Conference, Plymouth, NH, 1992
I.I.Vaisman, M.L.Berkowitz Structural peculiarities in liquid
DMSO and DMSO-water mixtures. CRYO'92 - 29th Annual Meeting
of Society for Cryobiology, Ithaca, NY, 1992, Abstacts, 62.
Y.P.Puhovski, I.I.Vaisman, M.G.Kiselev, Y.M.Kessler Conformational
analysis of a thymidine derivative in the gas phase and in a water-thymidine
mixture. 3rd European Symposium on Organic Reactivity,
G?teborg (Sweden), 1991, Abstracts, p.205.
I.I.Vaisman, Y.P.Puhovski, M.G.Kiselev, Y.M.Kessler Modelling
of hexamethyl phosphoric triamide solvation in aqueous electrolyte:
Molecular dynamics study . 10th IUPAC Conference on Physical
Organic Chemistry, Haifa (Israel), 1990, Abstracts, p.215.
Y.P.Puhovski, I.I.Vaisman, M.G.Kiselev, Y.M.Kessler MD study
of ionic mobility in aqueous electrolyte solutions. 4th Rostock
Conference on Classical Liquids and Solutions, Rostock (Germany),
1990.
R.S.Kumeev, I.I.Vaisman, Y.M.Kessler, I.A.Lukyanchikova Ionic
mobilities and organic solvent molecules microdynamics Second
World Congress of Theoretical Organic Chemists, Toronto (Canada),
1990, Abstracts, p.CP-11.
Y.P.Puhovski, M.G.Kiselev, I.I.Vaisman, Y.M.Kessler Thermodynamics
of Na+ and Cl- solvation in water-HMPT mixed solvent. VI National
Conference on Thermodynamics of Organic Compounds, Minsk (USSR),
1990, Abstracts, p.112.
I.I.Vaisman, M.G.Kiselev, Y.P.Puhovski, Y.M.Kessler Dynamics
of water molecules in water-HMPT-ion system from MD experiments.
II National Conference on Chemistry of Non-Aqueous Solutions,
Kharkov (USSR), 1989, Abstracts, v.1, p.14.
I.I.Vaisman, M.G.Kiselev, Y.P.Puhovski, Y.M.Kessler Solvation
of the Na+ ion in binary solvent water-HMPT. 44 International
Meeting on Physical Chemistry, Nancy (France), 1989, Abstracts,
p.28.
Y.M.Kessler, A.N.Petrov, I.I.Vaisman, M.G.Kiselev Influence of
ions on hydration of heterofunctional molecules. XIV Mendeleev
Congress on General and Applied Chemistry, Tashkent (USSR), 1989,
Proceedings, p.73.
I.I.Vaisman, Y.M.Kessler, M.G.Kiselev, Y.P.Puhovski Molecular
dynamics simulation of water-HMPT solution: structure, dynamics and
thermodynamics of hydration. 9th International Conference on
Chemical Thermodynamics and Calorimetry, Beijing (China), 1989,
Abstracts, p.C-38.
I.I.Vaisman, M.G.Kiselev, Y.P.Puhovski, Y.M.Kessler The Na+ ion
solvation in water-hexamethylphosphorictriamide solution: MD simulation.
XX International Conference on Solution Chemistry, Jerusalem
(Israel), 1989, Abstracts, p.92.
I.I.Vaisman, M.G.Kiselev, Y.P.Puhovski, Y.M.Kessler Solvation
and mobility of Na+ and Cl- ions in water-HMPT mixture. 7th
National Conference on Electrochemistry, Chernovtsy (USSR), 1988,
Abstracts, v.1, p.242.
Y.M.Kessler, R.S.Kumeev, I.I.Vaisman, R.H.Bratishko Ionic mobilities
at infinite dilution. XIX International Conference on Solution
Chemistry, Lund (Sweden), 1988, Abstracts, p.188.
Y.M.Kessler, I.I.Vaisman Structural effects in the ionic mobility.
National Conference on Acid-Base Equilibrium and Solvation,
Kharkov (USSR), 1987, Abstracts, p.75.
