Dataset Information

Turon2023 - H3D virtual screening models

ABSTRACT: The H3D virtual screening cascade contains models for Mycobacterium tuberculosis and Plasmodium falciparum IC50 predictions, as well as ADME, cytotoxicity, and solubility assays. Model Type: Predictive machine learning model. Model Relevance: This panel of models provides predictions for the H3D virtual screening cascade. Model Encoded by: Miquel Duran-Frigola (Ersilia) Metadata Submitted in BioModels by: Zainab Ashimiyu-Abdusalam Implementation of this model code by Ersilia is available here: https://github.com/ersilia-os/eos7kpb

SUBMITTER: Zainab Ashimiyu-Abdusalam