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Introduction to the BioChemical Library (BCL): an Application-Based Open-Source Toolkit for Integrated Cheminformatics and Machine Learning in Computer-Aided Drug Discovery

Benjamin P. Brown,Oanh Vu,Alexander R. Geanes,Sandeepkumar Kothiwale,Mariusz Butkiewicz,Edward W. Lowe,Ralf Mueller, Richard Pape,Jeffrey Mendenhall,Jens Meiler

Frontiers in Pharmacology（2022）

Cited 9|Views31
Key words
drug discovery,drug design,cheminformatics,open-source,deep neural network,QSAR,biochemical library,BCL
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