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Popular repositories

  1. alchemical-analysis

    Forked from MobleyLab/alchemical-analysis

    An open tool implementing some recommended practices for analyzing alchemical free energy calculations


  2. watertoolbox-protoms

    Forked from gregoryross/watertoolbox-protoms

    What will be a set of tools to calculate the binding free energies of individual water molecules from GCMC titration simulations with ProtoMS.

    Jupyter Notebook


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20 contributions in the last year

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Contribution activity

November 2018

matteoaldeghi has no activity yet for this period.

October 2018

Created an issue in rasbt/mlxtend that received 4 comments

Question: feature selection for gaussian processes with anisotropic kernels

I wonder whether it is possible to use SequentialFeatureSelector with anisotropic kernels in GaussianProcessRegressor. I understand it may be more …


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