ErtlFunctionalGroupsFinder: automated rule-based functional group detection with the Chemistry Development Kit (CDK)

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Author:Jonas Schaub, Sebastian Fritsch, Stefan Neumann, Christoph Steinbeck, Achim Zielesny
Parent Title (German):Konferenz: 15th German Conference on Cheminformatics GCC 2019, 3.-5. November 2019 in Mainz
Document Type:Conference Proceeding
Language:English
Date of Publication (online):2020/01/30
Year of first Publication:2019
Publishing Institution:Westfälische Hochschule Gelsenkirchen Bocholt Recklinghausen
Release Date:2020/01/30
Departments / faculties:Institute / Westfälisches Institut für Gesundheit
Licence (German):License LogoEs gilt das Urheberrechtsgesetz

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