Empirical temperature-dependent intermolecular potentials determined by data mining from crystal data
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference35 articles.
1. Molecular force fields. I. The structure of the water molecule;Heath;Trans. Faraday Soc.,1948
2. Potential functions and conformations in cycloalkanes;Bixon;Tetrahedron,1967
3. Refinement of protein conformations using a macromolecular energy minimization procedure;Levitt;J. Mol. Biol.,1969
4. Molecular dynamics study of temperature effects on water structure and kinetics;Stillinger;J. Chem. Phys.,1972
5. Conformational solitons in stacked systems;Hofmann;Phys. Rev. A,1988
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