Extra precision docking, free energy calculation and molecular dynamics simulation studies of CDK2 inhibitors-Reference-Cited by-同舟云学术

Extra precision docking, free energy calculation and molecular dynamics simulation studies of CDK2 inhibitors

Published:2013-10 Issue: Volume:334 Page:87-100
ISSN:0022-5193
Container-title:Journal of Theoretical Biology
language:en
Short-container-title:Journal of Theoretical Biology

Author:

Tripathi Sunil Kumar,Muttineni Ravikumar,Singh Sanjeev Kumar

Funder

Department of Science and Technology New Delhi

Alagappa University, Karaikudi for AURF

Publisher

Elsevier BV

Subject

Applied Mathematics,General Agricultural and Biological Sciences,General Immunology and Microbiology,General Biochemistry, Genetics and Molecular Biology,Modeling and Simulation,General Medicine,Statistics and Probability

Reference82 articles.

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3. Interaction models for water in relation to protein hydration;Berendsen;Intermol. Forces,1981

4. Molecular-dynamics with coupling to an external bath;Berendsen;J. Chem. Phys.,1984

5. The protein data bank;Berman;Nucleic Acids Res.,2000

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