Matched molecular pair-based data sets for computer-aided medicinal chemistry [v1; ref status: indexed, http://f1000r.es/2w9]

Matched molecular pairs (MMPs) are widely used in medicinal chemistry to study changes in compound properties including biological activity, which are associated with well-defined structural modifications. Herein we describe up-to-date versions of three MMP-based data sets that have originated from...

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Bibliographic Details
Main Authors: Ye Hu, Antonio de la Vega de León, Bijun Zhang, Jürgen Bajorath
Format: Article
Language:English
Published: F1000 Research Ltd 2014-02-01
Series:F1000Research
Subjects:
Online Access:http://f1000research.com/articles/3-36/v1