LAB
MOL
IN
SIGHT
LabMol InsightAI is an open science application that uses ML algorithms to
accelerate drug discovery and toxicity research.
PRED-hERG
Unlock the power of Pred-hERG: the state-of-the-art
tool employing machine learning to identify hERG channel blockage
and mitigate the potential for cardiac toxicity
PRED-SKIN
Fast, reliable, and user-friendly tool that incorporates multiple QSAR models developed with in
vitro,
in chemico, and in vivo data, integrated into a consensus Bayesian model that predicts human effects
of
skin sensitization potential of chemicals.
QSAR-LIT
Innovative and comprehensive workflow for data curation, QSAR modeling,
virtual screening and mechanistic interpretations, using an interactive and user-friendly
Streamlit dashboard, for computational toxicology and drug discovery projects.
CYTO-SAFE
Advancing Safety Assessment with AI-QSAR Models for
Predicting Cytotoxicity of Novel Drug Candidates
ODOR-SIGHT
Predict odorant molecules with explainable AI