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Development of Inhibitors of Protein-protein Interactions through REPLACE: Application to the Design and Development Non-ATP Competitive CDK Inhibitors
10:33

Development of Inhibitors of Protein-protein Interactions through REPLACE: Application to the Design and Development Non-ATP Competitive CDK Inhibitors

Published on: October 26, 2015

Improved convergence of binding affinities with free energy perturbation: application to nonpeptide ligands with

D J Price1, W L Jorgensen

  • 1Department of Chemistry, Yale University, New Haven, CT 06520-8107, USA.

Journal of Computer-Aided Molecular Design
|November 23, 2001
PubMed

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