New Soft-Core Potential Function for Molecular Dynamics Based Alchemical Free Energy Calculations

2012 | journal article

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​Gapsys V, Seeliger D, de Groot BL. ​New Soft-Core Potential Function for Molecular Dynamics Based Alchemical Free Energy Calculations​. ​​Journal of Chemical Theory and Computation. ​2012;​8​(7):​​2373​-2382​. ​doi:10.1021/ct300220p. 

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Authors
Gapsys, Vytautas ; Seeliger, Daniel; de Groot, Bert L. 
Issue Date
2012
Journal
Journal of Chemical Theory and Computation 
ISSN
1549-9618
eISSN
1549-9626
Language
English

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