Py-CoMSIA: An Open-Source Implementation of Comparative Molecular Similarity Indices Analysis in Python

<b>Background/Objectives:</b> The progression of three-dimensional (3D) quantitative structure–activity relationship (QSAR) methodologies has significantly contributed to the advancement of medicinal chemistry and pharmaceutical discovery. Comparative Molecular Similarity Indices Analysi...

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Bibliographic Details
Main Authors: Christopher L. Haga, Crystal N. Le, Xue D. Yang, Donald G. Phinney
Format: Article
Language:English
Published: MDPI AG 2025-03-01
Series:Pharmaceuticals
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Online Access:https://www.mdpi.com/1424-8247/18/3/440
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