DrugHarness: An Evolvable Agent Harness for Computational Drug Discovery
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DrugHarness is an evolvable agent framework for computational drug discovery that integrates over 80 scientific operations and induces reusable skills from execution trajectories. On MolBench, its affinity-comparison accuracy exceeds MolClaw-CC by 10.8 percentage points, and skill evolution raises Qwen's accuracy from 62.2% to 81.1%.
Excerpted from arxiv.org
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- arxiv.orgPickDrugHarness: An Evolvable Agent Harness for Computational Drug Discovery
DrugHarness is an evolvable agent framework for computational drug discovery that integrates over 80 scientific operations and induces reusable skills from execution trajectories. On MolBench, its affinity-comparison accuracy exceeds MolClaw-CC by 10.8 percentage points, and skill evolution raises Qwen's accuracy from 62.2% to 81.1%.
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