CDK Qsarmolecular

Artifacts using CDK Qsarmolecular (17)
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AMBIT 2 core functionality
Last Release on May 22, 2020
CDK Bundle
Last Release on Mar 4, 2026
IO
Last Release on Aug 1, 2024
Fingerprinter OSS
Last Release on Aug 1, 2024
Descriptors: pKA, functional groups, moleucle size, crossectional diameter, maximum diameter, molecular weight, spherosity, atom environment CDK descriptors, listed at http://qsar.sourceforge.net/dicts/qsar-descriptors/index.xhtml are available via ...
Last Release on May 22, 2020
Chemdb Utilities OSS
Last Release on Aug 1, 2024
Canopus Predict OSS
Last Release on Aug 1, 2024
CDK Depict
Last Release on Mar 4, 2026
CDK Qsarprotein
Last Release on Mar 4, 2026
Uses https://github.com/vedina/loom
Last Release on Jan 11, 2018