Multi-Scale Free Energy Landscape calculation method by combination of coarse-grained and all-atom models

Chemical Physics Letters

Volumn 503, Issue 1-3, 2011, Pages 145-152

  Harada, Ryuhei ^a,b   Kitao, Akio ^a,b  

^a UNIVERSITY OF TOKYO   (Japan)

^b JAPAN SCIENCE AND TECHNOLOGY AGENCY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ALL-ATOM MODEL; BIOMOLECULAR SYSTEM; CALCULATION METHODS; COARSE GRAINED MODELS; COARSE-GRAINED; CONFORMATIONAL SPACE; ENERGY LANDSCAPE; FREE-ENERGY LANDSCAPE; LOCAL ENERGY; MOLECULAR DYNAMICS SIMULATIONS; MULTISCALES; SAMPLING EFFICIENCY;

ATOMS; FREE ENERGY;

MOLECULAR DYNAMICS;

EID: 79751533108     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2011.01.017     Document Type: Article

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