Dear Guillaume,
This is a one liner in Python, the model is saved as a Python dictionary in the
case of the NP model and I believe the SA score is a Python list. Probably best
you work out what you want to do with it rather than have multiple versions of
such large files packaged with the source.
>>> import gzip, pickle
>>> rawData = pickle.load(gzip.open('publicnp.model.gz', 'rb'))
Best,
Nick
Nicholas C. Firth | PhD Student | Cancer Therapeutics
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On 6 Sep 2015, at 14:52, Guillaume GODIN
<[email protected]<mailto:[email protected]>> wrote:
Dear all,
I need the original unpickle data for javascript to implement those two
descriptor in RDKitjs.
Can you provide publicnp.model.gz fpscores.pkl.gz uncompressed files please ?
thanks in advance
Best regards,
Dr. Guillaume GODIN
Project Manager
Innovation
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