The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.
Hi, I incorporated the rephrasing of the fingerprint split in tutorial 5 from "This trains an XGBoost model using a provided fingerprint split." to "This trains an XGBoost model using a fingerprint split. The fingerprint split is provided with the dataset files." I also incorporated the changes from confluence into tutorial 8!
Hi, I incorporated the rephrasing of the fingerprint split in tutorial 5 from "This trains an XGBoost model using a provided fingerprint split." to "This trains an XGBoost model using a fingerprint split. The fingerprint split is provided with the dataset files." I also incorporated the changes from confluence into tutorial 8!