International Workshop MSSMBS 2006: Preliminary Program
September 18
Arrival and Registration in "Dubna" hotel
September 19
0930-1000Opening ceremony.
1000-1045 Alexander Nemukhin "Modeling properties of biomolecules by quantum mechanical √ molecular mechanical (QM/MM) methods"
Department of Chemistry, M.V.Lomonosov Moscow State University, Leninskie Gory 1/3, Moscow, 119992 Russia
1045-1130 Tatyana Feldman "Visual pigment rhodopsin: a computer simulation of the molecular dynamics of 11-cis-retinal chromophore and amino-acid residues in the chromophore centre"
Biochemical Physics Institute, Russian Academy of Sciences, 117997 Kosygin st. 4, Moscow, Russia
1130-1145Cofee Break.
1145-1230 Yousuke Ohno "MDGRAPE-3 System. A PFLOPS Special-Purpose Computer System for Molecular Dynamics Simulations "
High-performance Molecular Simulation Team, Computational & Experimental Systems Biology Group, Genomic Sciences Center, The Institute of Physical and Chemical Research, 1-7-22 Suehiro-cho, Tsurumi-ku, Yokohama City, Kanagawa, 230-0045, Japan
1230-1315 Konstantin Shaitan "Molecular dynamics of DNA, binding actinomycin D" M. V. Lomonosov Moscow State University, 119899 Khokhlov st. 1-12, Moscow, Russia
1315-1445Lunch.
1445-1530 Toshiki Mima"Molecular Dynamics Simulation on Confined Liquid Crystals"
Yasuoka Laboratory, Keio University
Hiyoshi 3-14-1, Kohoku-ku, Yokohama 223-8522, Japan
1530-1615 Ekaterina Miroshnichenko"Molecular Dynamics Simulation of RNA I-Motif"
Institute of Radiophysics and Electronics, NAS, 61085 Proskura st. 12, Kharkov, Ukraine
1615-1630 Cofee Break.
1630-1715 Robert Selwyne "Homology Modeling and Molecular Dynamics of Cyclin-Dependent Proteinkinases: yCDC28 and hCDK2"
Department of Botany, Bharahthiar University, Coimbatore-641046, TamilNadu, India
1715-1800 Aram Shahinyan "Simulation of Erythrocyte Membrane. Molecular Dynamics Study"
Institute of Applied Problems of Physics, National Academy of Sciences, 375014, H. Nersisyan str. 25, Yerevan, Armenia
1800-1845 Mikhail Avdeev "Nonmonotonic Behavior of the Concentration in the Kinetics
of Dissolution of Fullerenes"
Frank Laboratory of Neutron Physics, JINR (Joint Institute for Nuclear Research), 141980 Dubna, Moscow~region, Russia
1900Welcome Party.
September 20
915-1000 Masatoshi Furuya "Variation for Microscopic Structure of Ethanol/Cyclohexane Binary Liquid With Mole Fraction and Molecular Description of Self-Diffusion Coefficient of Ethanol"
Yasuoka Laboratory, Department of Mechanical Engineering, Keio University 3-14-1 Hiyoshi, Kohoku-ku, Yokohama 223-8522, Japan
1000-1045 Abdel Kenoufi
"Geometry optimization of complex materials systems" Center for Atomic-scale Materials Physics (CAMP), Department of Physics, Technical University of Denmark, Building 307 DK 2800 Kgs. Lyngby, Denmark
1045-1130 Ksenia Tereshkina "Molecular Dynamics of GlyR: ion migration"
M. V. Lomonosov Moscow State University, 119899 Khokhlov st. 1-12, Moscow, Russia
1130-1145 Cofee Break.
1145-1230 Tatyana Shchuka "Antimicrobial Peptide Magainin 2 Molecular Dynamics Simulation in Collision and Water Surroundings
"
M. V. Lomonosov Moscow State University, 119899 Khokhlov st. 1-12, Moscow, Russia
1230-1315 Dmitry Kretov "Molecular Dynamics Simulation of Substitution of Conservative Glycine by Serine In a G-loop of Mutant cdc28-srm of Yeast Using Crystal Lattice of Human Kinase CDK2"
Sector for Molecular Modeling, Laboratory of Radiation Biology, Joint Institute for Nuclear Research, 141980 Dubna, Moscow Region, Russia
1315-1445Lunch.
1445-1530 Vladimir Monastirny "MD Simulations of RecA Protein: The Influence of Amino Acid (Mutant) Exchanges In Beta-Sheet Loops and DNA Inhibition Sites"
Sector for Molecular Modeling, Laboratory of Radiation Biology, Joint Institute for Nuclear Research, 141980 Dubna, Moscow Region, Russia
1530-1615 Mikhail Altaisky "On the activation function of bipolar cells: a quantum mechanical model"
Sector for Molecular Modeling, Laboratory of Radiation Biology, Joint Institute for Nuclear Research, 141980 Dubna, Moscow Region, Russia
1615-1700 Yegor Tourleigh "Nonequlibrium study of nanotube-peptide complexes in their interaction with membranes"
M. V. Lomonosov Moscow State University, 119899 Khokhlov st. 1-12, Moscow, Russia
1700-1745 Kholmirzo Kholmurodov "Computer Molecular Simulations of Protein Structures (Cyclin-Dependent Kinases and Visual Pigment Rhodopsin)"
Sector for Molecular Modeling, Laboratory of Radiation Biology, Joint Institute for Nuclear Research, 141980 Dubna, Moscow Region, Russia