Open Drug Discovery Toolkit (ODDT) Files

Modular and comprehensive toolkit for use in cheminformatics

This is an exact mirror of the Open Drug Discovery Toolkit (ODDT) project, hosted at https://github.com/oddt/oddt. SourceForge is not affiliated with Open Drug Discovery Toolkit (ODDT).

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Name	Modified	Size	InfoDownloads / Week
Parent folder
ODDT 0.5.tar.gz	2017-12-14	7.4 MB	0
ODDT 0.5.zip	2017-12-14	7.4 MB	0
README.md	2017-12-14	228 Bytes	0
Totals: 3 Items		14.9 MB	0

Protein-Ligand Extended Connectivity (PLEC) fingerprint
PDBQT reader and writer for RDKit + Vina support
DUD-e database wrappers
standard deviation (SD) metric used in CASF
RIE and BEDROC metrics
minor bug fixes

Source: README.md, updated 2017-12-14

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Open Drug Discovery Toolkit (ODDT) Files

Modular and comprehensive toolkit for use in cheminformatics

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