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SLAS Discovery : Advancing Life Sciences R & D|January 13, 2023
Using chemical and biological data to predict drug toxicityAnika Liu, Srijit Seal, Hongbin Yang, et al.Chemical Research in Toxicology|February 1, 2021
Comparison of Cellular Morphological Descriptors and Molecular Fingerprints for the Prediction of Cytotoxicity- and Proliferation-Related AssaysSrijit Seal, Hongbin Yang, Luis Vollmers, et al.Communications Biology|August 23, 2022
Integrating cell morphology with gene expression and chemical structure to aid mitochondrial toxicity detectionSrijit Seal, Jordi Carreras-Puigvert, Maria-Anna Trapotsi, et al.Journal of Cheminformatics|June 2, 2023
Merging bioactivity predictions from cell morphology and chemical fingerprint models using similarity to training dataSrijit Seal, Hongbin Yang, Maria-Anna Trapotsi, et al.Journal of Cheminformatics|October 24, 2024
Graph neural processes for molecules: an evaluation on docking scores and strategies to improve generalizationMiguel García-Ortegón, Srijit Seal, Carl Rasmussen, et al.Biology Direct|January 19, 2021
Prediction and mechanistic analysis of drug-induced liver injury (DILI) based on chemical structureAnika Liu, Moritz Walter, Peter Wright, et al.Biorxiv : the Preprint Server for Biology|July 15, 2024
Step Forward Cross Validation for Bioactivity Prediction: Out of Distribution Validation in Drug DiscoveryUdit Surya Saha, Michele Vendruscolo, Anne E Carpenter, et al.Drug Discovery Today|March 26, 2026
AI agents in drug discovery: applications and case studiesDinh Long Huynh, Srijit Seal, Dylan Reid, et al.Molecular Biology of the Cell|January 3, 2024
From pixels to phenotypes: Integrating image-based profiling with cell health data as BioMorph features improves interpretabilitySrijit Seal, Jordi Carreras-Puigvert, Shantanu Singh, et al.Journal of Cheminformatics|September 27, 2025
PKSmart: an open-source computational model to predict intravenous pharmacokinetics of small moleculesSrijit Seal, Maria-Anna Trapotsi, Manas Mahale, et al.Pageof 64