화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 Extension of the Effective Fragment Potential Method to Macromolecules
Gurunathan PK, Acharya A, Ghosh D, Kosenkov D, Kaliman I, Shao YH, Krylov AI, Slipchenko LV
Journal of Physical Chemistry B, 120(27), 6562, 2016
2 Thermodynamics of Binding of Di- and Tetrasubstituted Naphthalene Diimide Ligands to DNA G-Quadruplex
Prato G, Silvent S, Saka S, Lamberto M, Kosenkov D
Journal of Physical Chemistry B, 119(8), 3335, 2015
3 Conformationally Locked Chromophores as Models of Excited-State Proton Transfer in Fluorescent Proteins
Baranov MS, Lukyanov KA, Borissova AO, Shamir J, Kosenkov D, Slipchenko LV, Tolbert LM, Yampolsky IV, Solntsev KM
Journal of the American Chemical Society, 134(13), 6025, 2012
4 Solvent Effects on the Electronic Transitions of p-Nitroaniline: A QM/EFP Study
Kosenkov D, Slipchenko LV
Journal of Physical Chemistry A, 115(4), 392, 2011
5 Evolution of Amide Stacking in Larger gamma-Peptides: Triamide H-Bonded Cycles
James WH, Buchanan EG, Muller CW, Dean JC, Kosenkov D, Slipchenko LV, Guo L, Reidenbach AG, Gellman SH, Zwier TS
Journal of Physical Chemistry A, 115(47), 13783, 2011
6 Noncovalent Interactions in Extended Systems Described by the Effective Fragment Potential Method: Theory and Application to Nucleobase Oligomers
Ghosh D, Kosenkov D, Vanovschi V, Williams CF, Herbert JM, Gordon MS, Schmidt MW, Slipchenko LV, Krylov AI
Journal of Physical Chemistry A, 114(48), 12739, 2010
7 Effect of a pH Change on the Conformational Stability of the Modified Nucleotide Queuosine Monophosphate
Kosenkov D, Kholod YA, Gorb L, Shishkin OV, Kuramshina GM, Dovbeshko GI, Leszczynski J
Journal of Physical Chemistry A, 113(33), 9386, 2009
8 Ab Initio Kinetic Simulation of Gas-Phase Experiments: Tautomerization of Cytosine and Guanine
Kosenkov D, Kholod Y, Gorb L, Shishkin O, Hovorun DM, Mons M, Leszczynski J
Journal of Physical Chemistry B, 113(17), 6140, 2009
9 Tautomeric equilibrium, stability, and hydrogen bonding in 2'-deoxyguanosine monophosphate complexed with Mg2+
Kosenkov D, Gorb L, Shishkin OV, Sponer J, Leszczynski J
Journal of Physical Chemistry B, 112(1), 150, 2008
10 Thermodynamics and kinetics of intramolecular water assisted proton transfer in Na+-1-methylcytosine water complexes
Michalkova A, Kosenkov D, Gorb L, Leszczynski J
Journal of Physical Chemistry B, 112(29), 8624, 2008