TeachOpenCADD: a teaching platform for computer-aided drug design using open source packages and data

TeachOpenCADD: a teaching platform for computer-aided drug design using open source packages and data

Abstract Owing to the increase in freely available software and data for cheminformatics and structural bioinformatics, research for computer-aided drug design (CADD) is more and more built on modular, reproducible, and easy-to-share pipelines. While documentation for such tools is available, there...

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Bibliographic Details
Main Authors: Dominique Sydow, Andrea Morger, Maximilian Driller, Andrea Volkamer
Format: Article
Language:English
Published: BMC 2019-04-01
Series:Journal of Cheminformatics
Subjects:
Computer-aided drug design
Python
RDKit
Open source
Teaching
Learning
Online Access:http://link.springer.com/article/10.1186/s13321-019-0351-x

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http://link.springer.com/article/10.1186/s13321-019-0351-x

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