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Chemsearch: collaborative compound libraries with structure-aware browsing.

Stephen G GaffneySarah SmagaAlanna SchepartzJeffrey P Townsend
Published in: Bioinformatics advances (2021)
Chemsearch is a free and open-source Flask web application that can be linked to a Google Workspace account. Source code is available at https://github.com/gem-net/chemsearch (GPLv3 license). A Docker image allowing rapid deployment is available at https://hub.docker.com/r/cgemcci/chemsearch.
Keyphrases
  • deep learning
  • quality improvement
  • network analysis
  • loop mediated isothermal amplification
  • machine learning
  • sensitive detection