화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 Computation of the Contribution from the Cavity Effect to Protein-Ligand Binding Free Energy
Grigoriev FV, Gabin SN, Romanov AN, Sulimov VB
Journal of Physical Chemistry B, 112(48), 15355, 2008
2 Cavitation free energy for organic molecules having various sizes and shapes
Grigoriev FV, Basilevsky MV, Gabin SN, Romanov AN, Sulimov VB
Journal of Physical Chemistry B, 111(49), 13748, 2007
3 Ab initio calculation of torsion and inversion barriers of the amino group in aminopyrimidines
Golovacheva AY, Romanov AN, Sulimov VB
Journal of Physical Chemistry A, 109(14), 3244, 2005
4 Excluded volume effect for large and small solutes in water
Basilevsky MV, Grigoriev FV, Leontyev IV, Sulimov VB
Journal of Physical Chemistry A, 109(31), 6939, 2005
5 Surface generalized born method: A simple, fast, and precise implicit solvent model beyond the coulomb approximation
Romanov AN, Jabin SN, Martynov YB, Sulimov AV, Grigoriev FV, Sulimov VB
Journal of Physical Chemistry A, 108(43), 9323, 2004
6 The binomial cell model of hydrophobic solvation
Alexandrovsky VV, Basilevsky MV, Leontyev IV, Mazo MA, Sulimov VB
Journal of Physical Chemistry B, 108(40), 15830, 2004