Simulation of ligand dissociation kinetics from the protein kinase <scp>PYK2</scp>-Reference-Cited by-同舟云学术

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Simulation of ligand dissociation kinetics from the protein kinase PYK2

Published:2022-09-08 Issue:28 Volume:43 Page:1911-1922
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Spiriti Justin¹,Noé Frank²³,Wong Chung F.¹^ORCID

Affiliation:

1. Department of Chemistry and Biochemistry University of Missouri‐St. Louis St. Louis Missouri USA

2. Department of Mathematics and Computer Science Freie Universität Berlin Berlin Germany

3. Department of Physics Freie Universität Berlin Berlin Germany

Funder

National Institutes of Health

National Science Foundation of Sri Lanka

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26991

Reference71 articles.

1. Lead discovery using molecular docking

2. Virtual ligand screening: strategies, perspectives and limitations

3. Flexible ligand–flexible protein docking in protein kinase systems

4. Efficient Drug Lead Discovery and Optimization

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