Research Groups - Musharof Chy
Jorgensen, William L.
Studies of organic reactions in solution and in enzymes using Monte Carlo and semiempirical QM/MM s...
Cambridge Centre for Computational Chemistry
Condensed matter science, surface science and statistical mechanics of complex and disordered syste...
Theoretical Chemistry Division, Royal Institute of Technology (KTH), Sweden
Ab initio quantum chemistry, molecular response properties, and nonlinear optical properties.
Theoretical Chemistry Group, University of Oslo
Ab initio quantum chemistry, molecular response properties, and explicitly correlated electronic wa...
Truhlar, Donald G.
Potential energy surfaces for chemical reaction dynamics; transition state theory with an emphasis ...
Tidor, Bruce
Structure and properties of proteins, nucleic acids, and their complexes. Investigations probe the ...
Jurs, Peters C.
Computer-assisted methods for investigating relationships linking molecular structures of organic c...
van Gunsteren, Wilfred F.
Molecular dynamics simulations of biomolecular systems. (ETH Hönggerberg)
Gasteiger Group
Computer-representation of chemical structures and reactions. Simulation of chemical reactions and ...
McCammon, J. Andrew
Simulations of biochemical reactions in solution, in proteins, and at membrane interfaces through s...
Agmon, Noam
Molecular reaction dynamics in condensed phases; simulations of biomolecules (Hebrew University, Je...