Scalable molecular dynamics with NAMD

Journal of Computational Chemistry

Volumn 26, Issue 16, 2005, Pages 1781-1802

  Phillips, James C ^a   Braun, Rosemary ^a   Wang, Wei ^a   Gumbart, James ^a   Tajkhorshid, Emad ^a   Villa, Elizabeth ^a   Chipot, Christophe ^b   Skeel, Robert D ^c   Kalé, Laxmikant ^c   Schulten, Klaus ^a  

^a UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

^b NANCY UNIVERSITÉ   (France)

^c University of Illinois at Urbana Champaign   (United States)

Author keywords

Biomolecular simulation; Molecular dynamics; Parallel computing

Indexed keywords

ALGORITHMS; C (PROGRAMMING LANGUAGE); COMPUTER SIMULATION; EQUATIONS OF MOTION; FREE ENERGY; MOLECULAR GRAPHICS;

BIOMOLECULAR SIMULATION; BIOMOLECULAR SYSTEMS; NAMD;

MOLECULAR DYNAMICS;

EID: 27344436659     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20289     Document Type: Review

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