Machine Language Model Building Floe Reference - Documentation

• Data Processing of Small Molecule for ML Model Building
• ML Build: Classification Model with Tuner using Fingerprints for Small Molecules
• ML Build: Regression Model with Tuner using Feature Input
• ML Build: Regression Model with Tuner using Fingerprints for Small Molecules
• ML Predict: Classification using Fingerprints for Small Molecules
• ML Predict: Regression using Feature Input
• ML Predict: Regression using Fingerprints for Small Molecules
• ML Predict: XGBoost for Small Molecules
• ML ReBuild: Transfer Learn ML Regression Model using Fingerprints for Small Molecules
• Solubility Prediction for Small Molecules using ML and Cheminfo Fingerprints
• hERG Toxicity Prediction for Small Molecules using ML and Cheminfo Fingerprints