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Alchemistry 2026

Our invited presentation introduced AnewSampling and AnewFEP, combining large-scale free-energy calculations with AI-driven molecular modeling for drug discovery.

May 4, 2026Conference

In May 2026, our team participated in the Alchemistry Free Energy Workshop in Barcelona, Spain — a leading international meeting focused on advances in free energy methods for drug discovery.

We delivered an invited presentation, “Learning the Thermodynamic Landscape of Protein–Ligand Interactions at Scale,” where we introduced our recent work on AnewSampling and AnewFEP, highlighting our efforts to combine advanced molecular sampling, large-scale free energy calculations, and AI-driven approaches for protein–ligand modeling and drug discovery.

We were pleased to share our work with the broader community and exchange ideas with experts in the field.

View Workshop Program