RetroTransformDB: A Dataset of Generic Transforms for Retrosynthetic Analysis

Presently, software tools for retrosynthetic analysis are widely used by organic, medicinal, and computational chemists. Rule-based systems extensively use collections of retro-reactions (transforms). While there are many public datasets with reactions in synthetic direction (usually non-generic rea...

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Bibliographic Details
Main Authors: Svetlana Avramova, Nikolay Kochev, Plamen Angelov
Format: Article
Language:English
Published: MDPI AG 2018-04-01
Series:Data
Subjects:
Online Access:http://www.mdpi.com/2306-5729/3/2/14