[OTDev] LogP modeling challenge
Egon Willighagen egon.willighagen at gmail.comWed Feb 23 13:09:29 CET 2011
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On Wed, Feb 23, 2011 at 1:05 PM, Nina Jeliazkova <jeliazkova.nina at gmail.com> wrote: > ALogP is so much worse that I didn't dare to send the comparison chart to a > public list :) > > http://apps.ideaconsult.net:8080/ambit2/chart/xy?dataset_uri=http://apps.ideaconsult.net%3A8080%2Fambit2%2Fdataset%2F186293&feature_uris[]=http%3A%2F%2Fapps.ideaconsult.net%3A8080%2Fambit2%2Ffeature%2F430904&feature_uris[]=http://apps.ideaconsult.net:8080/ambit2/feature/114589 Wow! Ummm... I suggest we remove this code from the cdk-1.3.x branch? Probably a good case of bit rot... maybe someone with time can fix it in master? Egon -- Dr E.L. Willighagen Postdoctoral Researcher Institutet för miljömedicin Karolinska Institutet 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
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