Published November 7, 2017 | Version 1.1.1
Software Open

3D-e-Chem/sygma: SyGMa 1.1.1

Authors/Creators

  • 1. Nederlands eScience Center

Description

SyGMa is a python library for the Systematic Generation of potential Metabolites. It is a reimplementation of the metabolic rules outlined in Ridder, L., & Wagener, M. (2008) SyGMa: combining expert knowledge and empirical scoring in the prediction of metabolites. ChemMedChem, 3(5), 821-832.

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3D-e-Chem/sygma-1.1.1.zip

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Additional details

Related works

Is supplement to
https://github.com/3D-e-Chem/sygma/tree/1.1.1 (URL)
References
10.1002/cmdc.200700312 (DOI)