On May 9, 2012, at 6:07 AM, Greg Landrum wrote:
FYI: I've been spending some time recently looking at scikit-learn and
have been quite impressed... there's a bit of writeup here:
http://code.google.com/p/rdkit/wiki/WorkingWithSciKitLearn
I've wanted a chance to use scikit-learn, as well as
On Mon, May 7, 2012 at 7:05 PM, Igor Filippov igor.v.filip...@gmail.com wrote:
Here's the example output:
*** Vote Results ***
misclassified: 93/242 (%38.43) 93/242 (%38.43)
Why the same set of numbers is printed twice?
If you do the predictions with a confidence threshold the
On Wed, May 2, 2012 at 2:05 PM, Igor Filippov igor.v.filip...@gmail.com wrote:
Dear Colleagues,
I am following the tutorials at
http://code.google.com/p/rdkit/wiki/BuildingModelsUsingDescriptors1
and
http://code.google.com/p/rdkit/wiki/BuildingModelsUsingFingerprints1
to use RDKit to build
Thank you, Greg!
As always, right on the mark!
If I may bother you just a bit more :)
Here's the example output:
*** Vote Results ***
misclassified: 93/242 (%38.43) 93/242 (%38.43)
Why the same set of numbers is printed twice?
average correct confidence:0.8520
average
Dear Colleagues,
I am following the tutorials at
http://code.google.com/p/rdkit/wiki/BuildingModelsUsingDescriptors1
and
http://code.google.com/p/rdkit/wiki/BuildingModelsUsingFingerprints1
to use RDKit to build a random forest model with floating point type
descriptors. Perhaps someone can
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