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  6. DHP catalyzed decarboxylative selenationDHP catalyzed decarboxylative selenation
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DHP

01-2001-2001--20Models performanceevaluation with MAF External prediction Model performance evaluationwith one hot encoding and RDKit 01-2001-2001--20Models performanceevaluation with MAF External prediction Model performance evaluationwith one hot encoding and RDKit

Nodes

  • Molecule Type Cast35 ×
  • Python Script (legacy)26 ×
  • RDKit Descriptor Calculation15 ×
  • Numeric Scorer8 ×
  • Excel Reader7 ×
  • Excel Writer7 ×
  • Joiner7 ×
  • X-Aggregator6 ×
  • X-Partitioner6 ×
  • Gradient Boosted Trees Learner (Regression)5 ×
  • Gradient Boosted Trees Predictor (Regression)5 ×
  • RDKit To InChI5 ×
  • GroupBy4 ×
  • One to Many4 ×
  • Column Appender3 ×
  • Column Filter1 ×
  • Column Rename1 ×
  • LIBSVMLearner1 ×
  • LIBSVMPredictor1 ×
  • Random Forest Learner (Regression)1 ×
  • Random Forest Predictor (Regression)1 ×
  • XGBoost Predictor (Regression)1 ×
  • XGBoost Tree Ensemble Learner (Regression)1 ×

Extensions

  • FeatureKNIME Base Chemistry Types & Nodes
  • FeatureKNIME Base nodes
  • FeatureKNIME Ensemble Learning Wrappers
  • FeatureKNIME Excel Support
  • FeatureKNIME LIBSVM Integration
  • Show all 9 modules

Links

  • No links available

Download

To use this workflow in KNIME, download it from the below URL and open it in KNIME:

Download Workflow
Created by: sushimin
Created at: 2021-11-22
On NodePit since: 2022-09-01
Last update: 2025-06-02
Created with KNIME version: v4.5.2

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