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Alan P. Graves
ORCID
Publication Activity (10 Years)
Years Active: 2020-2022
Publications (10 Years): 2
Top Topics
Sensitivity Analysis
Free Energy
Conceptual Model
Pairwise
Top Venues
J. Chem. Inf. Model.
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Publications
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Shunzhou Wan
,
Agastya P. Bhati
,
David W. Wright
,
Ian D. Wall
,
Alan P. Graves
,
Darren V. S. Green
,
Peter V. Coveney
Ensemble Simulations and Experimental Free Energy Distributions: Evaluation and Characterization of Isoxazole Amides as SMYD3 Inhibitors.
J. Chem. Inf. Model.
62 (10) (2022)
Guanglei Cui
,
Alan P. Graves
,
Eric S. Manas
GRAM: A True Null Model for Relative Binding Affinity Predictions.
J. Chem. Inf. Model.
60 (1) (2020)