Iterative-Molecular-Design
收藏NIAID Data Ecosystem2026-05-10 收录
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A closed-loop framework using G-SchNet and XPaiNN for multi-objective inverse molecular design via iterative fine-tuning.
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2025-10-13
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A closed-loop framework using G-SchNet and XPaiNN for multi-objective inverse molecular design via iterative fine-tuning.