From: SourceForge.net <no...@so...> - 2011-06-07 15:19:45
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Patches item #3313187, was opened at 2011-06-07 16:17 Message generated for change (Comment added) made by egonw You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=320024&aid=3313187&group_id=20024 Please note that this message will contain a full copy of the comment thread, including the initial issue submission, for this request, not just the latest update. Category: master Group: Needs Review Status: Open Resolution: None Priority: 5 Private: No Submitted By: Jonathan Alvarsson (jonalv) Assigned to: Nobody/Anonymous (nobody) Summary: suggested fix for bug 3310138 Initial Comment: The Tanimoto calcualtion for raw fingerprints was broken. This is an implementation of the continous tanimoto score used in DOI: 10.1021/ci800326z ---------------------------------------------------------------------- >Comment By: Egon Willighagen (egonw) Date: 2011-06-07 17:19 Message: A quick comment: 1. (minor) please use separate commits for separate fixes, allowing you to give more detail, e.g. on to what was wrong with the @TestMethod 2. please use {@cdk.cite} in the method JavaDoc rather than just listing the DOI. See for example the CMLReader class As to the change of algorithm, the original author should comment on that. ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=320024&aid=3313187&group_id=20024 |