Molecular & chemistry visualizations

Drug discovery, cheminformatics, and chemical biology queries produce these views. Structure viewers render from SMILES or ChEMBL IDs; ADMET radars are generated after property predictions.

ADMET Radar

Drug-likeness radar for Lipinski Rule of 5 and Veber rules — MW, LogP, HBA, HBD, TPSA, rotatable bonds. Violations highlighted in red.

Triggered by: ADMET prediction, drug-likeness queries

2D Structure Viewer

2D molecular structure from SMILES, InChI, or ChEMBL/DrugBank ID. Supports atom and bond highlighting.

Triggered by: drug detail queries, compound lookup

Molecular Similarity Matrix

Pairwise Tanimoto similarity heatmap across a compound set — reveals clusters, scaffolds, and diversity.

Ask: "Show similarity across these compounds"

SAR Viewer

Structure-activity relationship analysis — R-group tables, activity cliffs, and matched molecular pair views for lead optimization.

Ask: "Show the SAR for this series" or "Find activity cliffs"