Novartis’s molecular filter for Hit triage #chemoinformatics #RDKit

Recently there are lots of molecular filters are proposed. These filters are used for removing or prioritizing molecules for HTS library, hit triage etc. Long time ago(2013!) I posted about the molecular filter reported from Lilly’s group. https://iwatobipen.wordpress.com/2013/08/06/lilly%E3%81%AE%E3%83%95%E3%82%A3%E3%83%AB%E3%82%BF/comment-page-1/ The code filter can run from ruby script. And recent version of rdkit has some useful molecular