Additional file 1 of Chemoinformatics-based enumeration of chemical libraries: a tutorial
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Additional file 1. This document describes the substructure search in the ZINC database; the filter parameters for Congreve’s Rule of 3 used in the FAF-Drugs server; the instructions for filtering substructures in Data Warrior and Figure S1.
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figshare
创建时间：
2020-10-28
