ChemModLab is a facility for building and evaluating quantitative structure-activity (QSAR) models. There are three components to building such models: assay results, chemical descriptors, and a statistical model.

Researchers with new assay results can simply upload their assay data, whereupon various chemical descriptor sets can be computed, and numerous statistical models can be built and evaluated.

Similarly, researchers proposing new chemical descriptors or new modeling methods can fill in the other components in the discipline matrix necessary to evaluate their research. Thus, ChemModLab will enable researchers in any one of the component disciplines to test their results in an automatic and comprehensive way.

• Registration is NOT required to View Results on submitted assays.
• Registration is required to Submit Data (e.g., assays, descriptors, and responses).
• Registration is required to request Predictions using previously submitted data.
• A complete User’s Guide is available from the Help button.

Version: 2.0.1