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MCS: What's new

Tosco, Paolo (2023) MCS: What's new. RDKit blog.


This is only a brief summary, in form of a commented Jupyter Notebook, of the new MCS functionality that will be added in the new 2023.09 RDKit release.
This is going to be published as blog post on the RDKit blog (

Item Type: Article
Date Deposited: 22 Nov 2023 00:45
Last Modified: 22 Nov 2023 00:45