Alchemical Free-Energy Calculations by Multiple-Replica -Dynamics: The Conveyor Belt Thermodynamic Integration Scheme
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Date
2019-04-09Type
- Journal Article
Publication status
publishedExternal links
Journal / series
Journal of Chemical Theory and ComputationVolume
Pages / Article No.
Publisher
American Chemical SocietyOrganisational unit
08820 - Hünenberger, Philippe (Tit.-Prof.)
Funding
175944 - A Combinatorial Computational Chemistry Approach to Force-Field Development (SNF)
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