package lbvs_consent

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Chemoinformatics software for Ligand-Based Virtual Screening (LBVS) using consensus queries.

Install

Dune Dependency

Authors

Maintainers

Sources

v1.1.3.tar.gz
md5=3be9281c4c35e6e9380948aa2a2ac818

Description

Similarity search for molecules using several known active molecules (for a protein of interest) instead of a single query search. Details can be found in the paper: "Consensus queries in ligand-based virtual screening experiments". F. Berenger, O. Vu and J., Meiler. Journal of Cheminformatics, November 2017.

Published: 09 May 2018

Dev Dependencies

None

Used by

None

Conflicts

None

OCaml

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