Theoretical Studies on the Conformational Equilibria of the γ-Hydroxybutyric Acid in the Gas Phase and in Solution
- 1 August 1997
- journal article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry A
- Vol. 101 (33) , 5942-5948
- https://doi.org/10.1021/jp9710648
Abstract
No abstract availableKeywords
This publication has 28 references indexed in Scilit:
- Monte Carlo simulations of the counter ion effect on the conformational equilibrium of the N, N′-diphenyl-guanidinium ion in aqueous solutionThe Journal of Chemical Physics, 1996
- Competing Intra- and Intermolecular Hydrogen Bonds for Organic Solutes in Aqueous SolutionPublished by American Chemical Society (ACS) ,1994
- Comparison of 6-31G*-based MST/SCRF and FEP evaluations of the free energies of hydration for small neutral moleculesJournal of Computational Chemistry, 1993
- Theoretical studies of the 2- and 4-hydroxybenzoic acid with competing hydrogen bonds in the gas phase and aqueous solutionThe Journal of Physical Chemistry, 1993
- Theoretical calculations on 1,2-ethanediol. Gauche-trans equilibrium in gas-phase and aqueous solutionJournal of the American Chemical Society, 1991
- Semianalytical treatment of solvation for molecular mechanics and dynamicsJournal of the American Chemical Society, 1990
- Gamma-hydroxybutyrate, a possible neurotransmitterLife Sciences, 1987
- Comparison of simple potential functions for simulating liquid waterThe Journal of Chemical Physics, 1983
- Gamma hydroxybutyrateLife Sciences, 1977
- Electric Moments of Molecules in LiquidsJournal of the American Chemical Society, 1936