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A new directional model for the electronic frictional forces in molecular dynamics simulations of radiation damage in metals

✍ Scribed by C.P. Race; D.R. Mason; A.P. Sutton


Book ID
113731817
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
686 KB
Volume
425
Category
Article
ISSN
0022-3115

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## Abstract To test the anticorrelated relationship that was recently displayed in conventional molecular dynamics (MD) simulations, several different restrained MD simulations on a wild type and on the V82F/I84V drug‐resistant mutant of HIV‐1 protease were performed. This anticorrelated relationsh