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List of works by John W Mayfield

Algorithmic Analysis of Cahn-Ingold-Prelog Rules of Stereochemistry: Proposals for Revised Rules and a Guide for Machine Implementation

scientific article published on 17 August 2018

Cheminformatics for genome-scale metabolic reconstructions ⬇️

PhD thesis at Cambridge University

Efficient ring perception for the Chemistry Development Kit

scientific article

Erratum to: The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

scientific article published on 20 September 2017

Metingear: a development environment for annotating genome-scale metabolic models

scientific article (publication date: 13 June 2013)

Reaction Decoder Tool (RDT): extracting features from chemical reactions

scientific article (publication date: July 2016)

Technical implications of new IUPAC elements in cheminformatics

scientific article

The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

scientific article

ZINC20-A Free Ultralarge-Scale Chemical Database for Ligand Discovery

scientific article published on 29 October 2020

libChEBI: an API for accessing the ChEBI database

scientific article (publication date: March 2016)

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