Chemistry with Python - an Introduction to RDKit
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YouTubeBernhard Knasmueller
Chemistry with Python - an Introduction to RDKit
Learn how to perform basic chemistry operations with Python and RDKit. 0:00 Intro 0:25 Project setup 0:45 The SMILES format 2:04 Importing molecules 5:59 Operations on molecules 10:25 Molecular descriptors 14:15 Lipinski's rule of five 16:13 Summary WHO AM I: I'm Bernhard, a software engineer working in Vienna, Austria. I make videos about ...
52.2K viewsApr 25, 2021
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