ChemScanner: extraction and re-use(ability) of chemical information from common scientific documents containing ChemDraw files

Abstract We developed ChemScanner, a software that can be used for the extraction of chemical information from ChemDraw binary (CDX) or ChemDraw XML-based (CDXML) files and to retrieve the ChemDraw scheme from DOC, DOCX or XML documents. This can facilitate the reuse of chemical information embedded...

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Bibliographic Details
Main Authors: An Nguyen, Yu-Chieh Huang, Pierre Tremouilhac, Nicole Jung, Stefan Bräse
Format: Article
Language:English
Published: BMC 2019-12-01
Series:Journal of Cheminformatics
Subjects:
CDX
Online Access:https://doi.org/10.1186/s13321-019-0400-5