SEISMO: Increasing Sample Efficiency in Molecular Optimization with a Trajectory-Aware LLM Agent.

Sun, 01 Feb 2026 00:00:00 +0100

Fabian Krüger, Andrea Hunklinger, Adrian Wolny, Tim J. Adler, Igor V. Tetko, Santiago David Villalba:
SEISMO: Increasing Sample Efficiency in Molecular Optimization with a Trajectory-Aware LLM Agent. CoRR abs/2602.00663 (2026)