Accelerating the Calculation of Protein-Ligand Binding Free Energy and Residence Times Using Dynamically Optimized Collective Variables
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Date
2019-01-08Type
- Journal Article
Publication status
publishedExternal links
Journal / series
Journal of Chemical Theory and ComputationVolume
Pages / Article No.
Publisher
American Chemical SocietyOrganisational unit
03575 - Parrinello, Michele (ehemalig) / Parrinello, Michele (former)
Funding
163284 - Structural Studies of Aggregates and Membrane Proteins (SNF)
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