6533b873fe1ef96bd12d4d05

RESEARCH PRODUCT

Filtered circular fingerprints improve either prediction or runtime performance while retaining interpretability

Martin GütleinStefan Kramer

subject

Physical and Theoretical ChemistryLibrary and Information Sciences004 InformatikComputer Graphics and Computer-Aided Design004 Data processingComputer Science Applications
yearjournalcountryeditionlanguage
2016-01-01Journal of Cheminformatics
10.1186/s13321-016-0173-zhttp://dx.doi.org/10.1186/s13321-016-0173-z