Consistent Prediction of Mutation Effect on Drug Binding in HIV-1 Protease Using Alchemical Calculations

2018 | journal article

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​Bastys, Tomas, et al. "Consistent Prediction of Mutation Effect on Drug Binding in HIV-1 Protease Using Alchemical Calculations​." ​Journal of Chemical Theory and Computation, vol. 14, no. 7, ​2018, pp. 3397​-3408​, ​doi: 10.1021/acs.jctc.7b01109. 

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Authors
Bastys, Tomas; Gapsys, Vytautas ; Doncheva, Nadezhda T.; Kaiser, Rolf; de Groot, Bert L. ; Kalinina, Olga V.
Issue Date
2018
Journal
Journal of Chemical Theory and Computation 
ISSN
1549-9618
eISSN
1549-9626
Language
English

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