Cluster Software programs: I have a set of compounds ( say 10000 ); I want to cluster them or group them into certain properties( say structures). How can I group them? Is there any software or online server to do it?
Rapidminer (community version) and WEKA are the most user friendly
Also, take a look at KNIME. Its GUI is perfect for beginners.
Thank U Dmytro :)
Target identification -> HTVS -> Glide XP -> e-pharmacophore mapping?
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see above
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e-pharmacophore explanation.
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