Article

A Chemographic Audit of Anti-Coronavirus Structure-Activity Information from Public Databases (ChEMBL)

2020-04-10

Abstract excerpt

Discovery of drugs against newly emerged pathogenic agents like the SARS-CoV-2 coronavirus (CoV) must be based on previous research against related species. Scientists need to get acquainted with and develop a global oversight over so-far tested molecules. Chemography (herein used Generative Topographic Mapping, in particular) places structures on a human-readable 2D map (obtained by dimensionality reduction...

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Literature Corpus work: f1ce290a-b5e4-5387-b7da-7ac0975a97e3
DOI: 10.26434/chemrxiv.12104010.v1

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