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Molecular docking and MD: mimicking the real biological process

  • Varruchi Sharma , Anil Panwar , Girish Kumar Gupta and Anil K. Sharma EMAIL logo
Published/Copyright: January 20, 2022
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Abstract

In the processes of molecular docking and simulation studies; the computational techniques have a vast and significant role in drug discovery process. The rigid view in the binding of both target and ligand is the basis of modeling strategy process. More evolution to such processes with the time has lead in revealing the path of understanding the dynamic nature of binding processes. In this chapter we have focused on molecular docking along with dynamic studies in reference to biological processes.


Corresponding author: Anil K. Sharma, Department of Biotechnology, Maharishi Markandeshwar (Deemed to be University), Mullana-Ambala, Haryana, 133207, India, E-mail:

  1. Author contributions: All the authors have accepted responsibility for the entire content of this submitted manuscript and approved submission.

  2. Research funding: None declared.

  3. Conflict of interest statement: The authors declare no conflicts of interest regarding this article.

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Published Online: 2022-01-20

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