CIFDock : A novel CHARMM ‐based flexible receptor–flexible ligand docking protocol-Reference-Cited by-同舟云学术

CIFDock : A novel CHARMM ‐based flexible receptor–flexible ligand docking protocol

Published:2021-11-06 Issue:2 Volume:43 Page:84-95
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Vankayala Sai L.¹,Warrensford Luke C.¹,Pittman Amanda R.¹,Pollard Benjamin C.²,Kearns Fiona L.¹,Larkin Joseph D.²,Woodcock H. Lee¹^ORCID

Affiliation:

1. Department of Chemistry Eckerd College St. Petersburg Florida USA

2. Department of Chemistry University of South Florida Tampa Florida USA

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26759

Reference68 articles.

1. S. L.Vankayala Computational Approaches for Structure Based Drug Design and Protein Structure‐Function Prediction Graduate Thesis and Dissertation University of South Florida2013.

2. Application of the Three-Dimensional Structures of Protein Target Molecules in Structure-Based Drug Design

3. Crystal structure of HIV-1 protease in complex with VX-478, a potent and orally bioavailable inhibitor of the enzyme

4. Structural Mechanism for STI-571 Inhibition of Abelson Tyrosine Kinase

5. Towards the development of universal, fast and highly accurate docking/scoring methods: a long way to go

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