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"New Features of the Open Source Monte Carlo Software Brick-CFCMC: ..."

H. Mert Polat et al. (2021)

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DOI: 10.1021/ACS.JCIM.1C00652

access: closed

type: Journal Article

metadata version: 2023-09-30

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  - journals/jcisd/PolatSHWRMHCCDM21
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  - https://dblp.org/rec/journals/jcisd/PolatSHWRMHCCDM21
H. Mert Polat, Hirad S. Salehi, Remco Hens, Dominika O. Wasik, Ahmadreza Rahbari, Frédérick de Meyer, Céline Houriez, Christophe Coquelet, Sofía Calero, David Dubbeldam, Othonas A. Moultos, Thijs J. H. Vlugt:
New Features of the Open Source Monte Carlo Software Brick-CFCMC: Thermodynamic Integration and Hybrid Trial Moves. J. Chem. Inf. Model. 61(8): 3752-3757 (2021)

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