A black-box re-weighting analysis can correct flawed simulation data

Proceedings of the National Academy of Sciences of the United States of America

Volumn 105, Issue 23, 2008, Pages 7982-7987

  Ytreberg, F Marty ^a   Zuckerman, Daniel M ^b  

^a UNIVERSITY OF IDAHO   (United States)

^b UNIVERSITY OF PITTSBURGH SCHOOL OF MEDICINE   (United States)

Author keywords

Canonical sampling; Free energy; Molecular simulation; Non Boltzmann

Indexed keywords

PEPTIDE; DIPEPTIDE; LEUCINE;

ALGORITHM; ARTICLE; PRIORITY JOURNAL; SIMULATION; STATISTICAL ANALYSIS; CHEMISTRY; COMPUTER SIMULATION; THERMODYNAMICS;

COMPUTER SIMULATION; DIPEPTIDES; LEUCINE; THERMODYNAMICS;

EID: 45849133760     PISSN: 00278424     EISSN: 10916490     Source Type: Journal    
DOI: 10.1073/pnas.0706063105     Document Type: Article

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