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Advanced Machine Learning - Chemistry Solution

Machine learning Data mining Classification Prediction Model evaluation
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Solution to the "Advanced Machine Learning Chemistry" exercise for the advanced Life Science User Training - Training a Random Forest model to predict a nominal target column - Evaluating the performance of a classification model - Optimizing parameters of the Random Forest model - Performing the classification multiple times in a cross validation loop

Used extensions & nodes

Created with KNIME Analytics Platform version 4.2.3
  • KNIME Base nodes Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.2.2

    knime
  • KNIME Ensemble Learning Wrappers Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.2.0

    knime
  • KNIME JavaScript Views Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.2.2

    knime
  • KNIME JavaScript Views (Labs) Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.2.2

    knime
  • KNIME Optimization extension Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.2.0

    knime
  • RDKit KNIME integration Trusted extension

    NIBR

    Version 4.0.1

    manuelschwarze
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