Ryan Varghese

Kryptix-1 improves cryptic pocket detection by combining conformational sampling with a consensus algorithm, outperforming static-structure methods and prior computational approaches on a benchmark dataset.

Mavchen-1 improves ligand pose prediction by using conformational ensembles, outperforming AlphaFold2 in specific binding mechanisms.

CHIMIYA-1 is a foundation model for ADMET property prediction that outperforms many public methods on the TDC ADMET benchmark, with strong performance on toxicity and physicochemical endpoints.