Computational chemistry: Application to biological systems

Molecular Simulation

Volumn 26, Issue 1, 2001, Pages 73-83

  Gould, Ian R ^a  

^a IMPERIAL COLLEGE LONDON   (United Kingdom)

Author keywords

DNA and visualisation; Molecular Dynamics; Molecular Mechanics; Proteins; Quantum Mechanics

Indexed keywords

EID: 0035037319     PISSN: 08927022     EISSN: None     Source Type: Journal    
DOI: 10.1080/08927020108024201     Document Type: Article

References (6)

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3. Halgren, T. A. (1999). "MMFF VII. Characterization of MMFF94, MMFF94s, and other widely available force fields for conformational energies and for intermolecular-interaction energies and geometries", J. Comp. Chem., 20, 730.
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6. Duan, Y., Wang, L. and Kollman, P. A. (1998). "The early stage of folding of villin headpiece subdomain observed in a 200-nanosecond fully solvated molecular dynamics simulation", Proceedings of the National Academy of Sciences of the United States of America, 95, 9897.