Instruction-tuned LLMs trained on C-MuMOInstruct, a new controllable multi-property molecule optimization dataset, outperform strong baselines on in-distribution and out-of-distribution optimization tasks.
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Large Language Models for Controllable Multi-property Multi-objective Molecule Optimization
Instruction-tuned LLMs trained on C-MuMOInstruct, a new controllable multi-property molecule optimization dataset, outperform strong baselines on in-distribution and out-of-distribution optimization tasks.