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Development and Benchmarking of Open Force Field V1.0.0, the Parsley Small Molecule Force Field

Yudong Qiu,Daniel G. A. Smith,Simon Boothroyd,Hyesu Jang,David F. Hahn,Jeffrey Wagner,Caitlin C. Bannan,Trevor Gokey,Victoria T. Lim,Chaya D. Stern,Andrea Rizzi,Bryon Tjanaka,Gary Tresadern,Xavier Lucas,Michael R. Shirts,Michael K. Gilson,John D. Chodera,Christopher Bayly,David L. Mobley,Lee-Ping Wang

Journal of Chemical Theory and Computation（2021）

Cited 98|Views17
Key words
Force Field
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