tag:blogger.com,1999:blog-684443317148892945.post8326336094350372667..comments2024-02-29T23:54:39.092-08:00Comments on RDKit: Finding Related Documents in ChEMBL 2greg landrumhttp://www.blogger.com/profile/10263150365422242369noreply@blogger.comBlogger1125tag:blogger.com,1999:blog-684443317148892945.post-13623852258301194002013-12-15T13:13:14.070-08:002013-12-15T13:13:14.070-08:00Great to see the chemfps in action!
What do you th...Great to see the chemfps in action!<br />What do you think about using defaultdict(set) in snippets [8] and [21]?<br /><br />molDocs=defaultdict(set)<br />for regno,doc_id in data:<br /> molDocs[regno].add(doc_id)<br /><br />That way you could skip the look-up check. Anonymoushttps://www.blogger.com/profile/18414967060522745603noreply@blogger.com