Variational approach to enhanced sampling and free energy calculations

Physical Review Letters

Volumn 113, Issue 9, 2014, Pages

  Valsson, Omar ^a   Parrinello, Michele ^a  

^a UNIVERSITY OF LUGANO   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

MOLECULAR DYNAMICS; MONTE CARLO METHODS; VARIATIONAL TECHNIQUES;

COLLECTIVE VARIABLES; ENHANCED SAMPLINGS; FREE ENERGY LANDSCAPE; FREE ENERGY SURFACE; FREE-ENERGY CALCULATIONS; SAMPLING PROBLEMS; VARIATIONAL APPROACHES; VARIATIONAL PRINCIPLES;

FREE ENERGY;

EID: 84907377430     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.113.090601     Document Type: Article

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