Hi Till, Have you found one?
Nothing immediately jumps out from recent history - https://github.com/cdk/cdk/blob/master/base/standard/src/main/java/org/openscience/cdk/fingerprint/Fingerprinter.java Further history I see count fingerprints introduced but that shouldn't change the bits - https://github.com/cdk/cdk/commits/1a30dfbbd6b114f0f9e9f54c526ddcd6c92cb804/src/main/org/openscience/cdk/fingerprint/Fingerprinter.java However if you're relying on the bits matching exactly based on a previous calculation I would recalculate to be sure. John Regards, John W May john.wilkinson...@gmail.com On 4 November 2015 at 13:09, Egon Willighagen <egon.willigha...@gmail.com> wrote: > Dear Till, > > neither. The default (oldest) CDK fingerprint is like the Daylight > fingerprint (using the same approach), but is not meant to be > identical. > > Grtz, > > Egon > > On Wed, Nov 4, 2015 at 2:05 PM, Till Schäfer > <till2.schae...@tu-dortmund.de> wrote: > > Hi, > > i would like to know if the daylight fingerprint should be identical for > the latest CDK 1.4 and the latest CDK 1.5. Are there any changes, that > cause another ordering of the features, or some feature to be detected > differently? > > > > Regards, > > Till > > > > -- > > Dipl.-Inf. Till Schäfer > > TU Dortmund University > > Chair 11 - Algorithm Engineering > > Otto-Hahn-Str. 14 / Room 237 > > 44227 Dortmund, Germany > > > > e-mail: till.schae...@cs.tu-dortmund.de > > phone: +49(231)755-7706 > > fax: +49(231)755-7740 > > web: http://ls11-www.cs.uni-dortmund.de/staff/schaefer > > pgp: > https://keyserver2.pgp.com/vkd/SubmitSearch.event?&&SearchCriteria=0xD84DED79 > > > > > ------------------------------------------------------------------------------ > > _______________________________________________ > > Cdk-user mailing list > > Cdk-user@lists.sourceforge.net > > https://lists.sourceforge.net/lists/listinfo/cdk-user > > > > -- > E.L. Willighagen > Department of Bioinformatics - BiGCaT > Maastricht University (http://www.bigcat.unimaas.nl/) > Homepage: http://egonw.github.com/ > LinkedIn: http://se.linkedin.com/in/egonw > Blog: http://chem-bla-ics.blogspot.com/ > PubList: http://www.citeulike.org/user/egonw/tag/papers > ORCID: 0000-0001-7542-0286 > ImpactStory: https://impactstory.org/EgonWillighagen > > > ------------------------------------------------------------------------------ > _______________________________________________ > Cdk-user mailing list > Cdk-user@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/cdk-user >
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