Showing results (1-10 of 7) with videos related to
Sort By:
Pageof 1
Journal of Computational Chemistry|March 21, 2008
Nonadditive effects in ternary H2-cation-PAH systemsAlexander G DonchevPhysical Review Letters|December 13, 2006
Contribution of quantum molecular flexibility to the second virial coefficient of water vaporAlexander G Donchev, Nikolay G Galkin, Vladimir I TarasovThe Journal of Physical Chemistry. B|March 13, 2015
Water dispersion interactions strongly influence simulated structural properties of disordered protein statesStefano Piana, Alexander G Donchev, Paul Robustelli, et al.Proceedings of the National Academy of Sciences of the United States of America|July 26, 2008
Application of a polarizable force field to calculations of relative protein-ligand binding affinitiesOleg Khoruzhii, Alexander G Donchev, Nikolay Galkin, et al.The Journal of Chemical Physics|November 4, 2017
Improving the accuracy of Møller-Plesset perturbation theory with neural networksRobert T McGibbon, Andrew G Taube, Alexander G Donchev, et al.Journal of Computational Chemistry|December 29, 2007
Assessment of performance of the general purpose polarizable force field QMPFF3 in condensed phaseAlexander G Donchev, Nikolay G Galkin, Alexey A Illarionov, et al.Scientific Data|February 11, 2021
Quantum chemical benchmark databases of gold-standard dimer interaction energiesAlexander G Donchev, Andrew G Taube, Elizabeth Decolvenaere, et al.Pageof 1