IconView PDB Structures 

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 […]

Icon03_​Network_​Example_​Of_​A_​Simple_​MLP 

This workflow shows how to create an MLP with a softmax layer for classification.

Icon08_​Interactive_​Webportal_​Visualisation_​of_​Neighbor_​Network 

The data, from patent WO-1996030347-A1, were exported from SureChEMBL and preprocessed with RDKit KNME nodes in a separate workflow. The workflow […]

Icon18358 

Model Interpretability: SHAP to explain predictions of Decision Tree Demonstrates use of SHAP implemenatation in KNIME 4.0 and generates a basic […]

Icon04c. GenericJS View optional 

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 […]

IconIndividuare il diabete_​(SMOTE) 

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 […]

Icon03_​Simple_​MMP_​Example 

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 […]

IconIndividuare il diabete 

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 […]

Icon3. My First ANN 

KBL: My First Artificial Neural Network An exercise on classification with a multi-layer perceptron URL: KNIME Beginner's Luck (Book […]