PopShift: A Thermodynamically Sound Approach to Estimate Binding Free Energies by Accounting for Ligand-Induced Population Shifts from a Ligand-Free Markov State Model is a research paper published in Journal of Chemical Theory and Computation (2024). On theSindex it has a DataRank of 0. It has been cited 14 times.
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Division of Molecular and Cellular Biosciences
Grant: MCB-2218156
National Institute on Aging
Grant: NIA RF1AG067194
National Institute of General Medical Sciences
Grant: R01GM132386
National Institute of General Medical Sciences
Grant: R35GM148236
NIA NIH HHS
Grant: RF1 AG067194
National Institutes of Health
Grant: 1RF1AG067194-01A1
Structural basis for ApoE4-induced Alzheimer's disease
National Science Foundation
Grant: 2218156
Decrypting the functional significance of cryptic surfaces by combining simulations and experiments
National Institutes of Health
Grant: 5R01GM132386-03
Open data-driven infrastructure for building biomolecular force fields for predictive biophysics and drug design
National Institutes of Health
Grant: 5R35GM148236-02
Accelerating drug discovery via ML-guided iterative design and optimization
National Institutes of Health
Grant: 1Z01AG000870-01
RGS2 Constitutes A Negative Regulator of Beta2-Adrenergic Gi Signaling
Basser Center for BRCA, University of Pennsylvania
David and Lucile Packard Foundation
FWCI
2.19
Citation Percentile
0.9%
Citation Trend
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