This workflow allows to interactively explore in 3D the PDB structure with the small molecule ligand. The RCSB PDB is accessed via the PDB Connector Query […]
This workflow shows how to create an MLP with a softmax layer for classification.
The data, from patent WO-1996030347-A1, were exported from SureChEMBL and preprocessed with RDKit KNME nodes in a separate workflow. The workflow […]
Model Interpretability: SHAP to explain predictions of Decision Tree Demonstrates use of SHAP implemenatation in KNIME 4.0 and generates a basic […]
URL: Decision Tree Node: Algorithm Settings https://youtu.be/CSwM92yTrJw
Relations in data with scatter and 3-D scatter This exercise focuses on learning about the relations among the data of prices of the houses in […]
In questo workflow, per uso didattico, si utilizza la tecnica di machine learning Decision Tree per predire se una persona sia diabetica/pre-diabetica, o […]
This workflow provides a simple example of generating matched molecular pairs (MMPs) from a set of compounds and using them to predict models with improved […]
In questo workflow, per uso didattico, si utilizza la tecnica di machine learning Decision Tree per predire se una persona sia diabetica/pre-diabetica, o […]
KBL: My First Artificial Neural Network An exercise on classification with a multi-layer perceptron URL: KNIME Beginner's Luck (Book […]
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