CRAFT: a web-integrated cavity prediction tool based on flow transfer algorithm

CRAFT: a web-integrated cavity prediction tool based on flow transfer algorithm

Abstract Numerous computational methods, including evolutionary-based, energy-based, and geometrical-based methods, are utilized to identify cavities inside proteins. Cavity information aids protein function annotation, drug design, poly-pharmacology, and allosteric site investigation. This article...

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Bibliographic Details
Main Authors: Anuj Gahlawat, Anjali Singh, Hardeep Sandhu, Prabha Garg
Format: Article
Language:English
Published: BMC 2024-01-01
Series:Journal of Cheminformatics
Subjects:
Cavity prediction
Flow transfer algorithm
CRAFT
Delaunay triangulation
Maximum circle radius (MCR)
Protein cavities
Online Access:https://doi.org/10.1186/s13321-024-00803-6

Internet

https://doi.org/10.1186/s13321-024-00803-6

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