Molecular mechanics and electrostatic effects
- 31 August 1994
- journal article
- research article
- Published by Elsevier in Biophysical Chemistry
- Vol. 51 (2-3) , 235-241
- https://doi.org/10.1016/0301-4622(94)00044-1
Abstract
No abstract availableKeywords
This publication has 45 references indexed in Scilit:
- Aspects of protein energetics and dynamicsProgress in Biophysics and Molecular Biology, 1993
- Dielectric and thermodynamic response of a generalized reaction field model for liquid state simulationsThe Journal of Chemical Physics, 1993
- Computer simulation study of the mean forces between ferrous and ferric ions in waterThe Journal of Physical Chemistry, 1992
- Microscopic simulations of macroscopic dielectric constants of solvated proteinsThe Journal of Chemical Physics, 1991
- Incorporating solvent and ion screening into molecular dynamics using the finite‐difference Poisson–Boltzmann methodJournal of Computational Chemistry, 1991
- Molecular dynamics simulations of water with Ewald summation for the long range electrostatic interactionsChemical Physics Letters, 1991
- Calculating the electrostatic potential of molecules in solution: Method and error assessmentJournal of Computational Chemistry, 1988
- Calculations of electrostatic energies in proteinsJournal of Molecular Biology, 1985
- On the calculation of the dielectric constant using the Ewald-Kornfeld tensorChemical Physics Letters, 1983
- Molecular Dynamics Study of Liquid WaterThe Journal of Chemical Physics, 1971