Open-Source Browser-Based Tools for Structure-Based Computer-Aided Drug Discovery

We here outline the importance of open-source, accessible tools for computer-aided drug discovery (CADD). We begin with a discussion of drug discovery in general to provide context for a subsequent discussion of structure-based CADD applied to small-molecule ligand discovery. Next, we identify usabi...

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Bibliographic Details
Published in:Molecules
Main Authors: Ann Wang, Jacob D. Durrant
Format: Article
Language:English
Published: MDPI AG 2022-07-01
Subjects:
computer docking
computer-aided drug discovery
tool development
open source
usability
web-based tools
Online Access:https://www.mdpi.com/1420-3049/27/14/4623

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https://www.mdpi.com/1420-3049/27/14/4623

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