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Schrödinger Materials Science AutoQSAR for Machine Learning
Build quantitative structure-activity relationships (QSAR) automatically for molecular systems with Schrödinger's AutoQSAR tool
Supporting Docs
- Machine_Learning_for_Materials_Science.pdf
- Machine_Learning_for_Ionic_Conductivity.pdf
- Cheminformatics_Machine_Learning_for_Homogeneous_Catalysis.pdf
- Data-Driven Materials Innovation: where Machine Learning Meets Physics
- Hands-On Workshop in nanoHUB: Machine Learning Models for Ionic Conductivity with Schrödinger's AutoQSAR