Machine learning vs. field 3D-QSAR models for serotonin 2A receptor psychoactive substances identification
Author:
Affiliation:
1. Department of Analytical, Environmental and Forensic Sciences
2. King's College London
3. London
4. UK
Abstract
Five QSAR models for predicting the affinity of 5-HT2AR ligands have been developed. The resulting models generate a useful tool for the investigation and identification of unclassified new psychoactive substances (NPS).
Funder
European Commission
Publisher
Royal Society of Chemistry (RSC)
Subject
General Chemical Engineering,General Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2021/RA/D1RA01335A
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