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Efficient Monte Carlo method for free energy evaluation of polymer chains

โœ Scribed by Jiro Sadanobu; William A. Goddard III

Book ID
108446008
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
378 KB
Volume
144
Category
Article
ISSN
0378-3812

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## Abstract We present a method of parallelizing flat histogram Monte Carlo simulations, which give the free energy of a molecular system as an output. In the serial version, a constant probability distribution, as a function of any system parameter, is calculated by updating an external potential