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1Institute for Chemical Reaction Design and Discovery (WPI-ICReDD), Hokkaido University, Sapporo, 001-0021, Japan.
机器学习加速了化学中的新型化合物设计. 本研究探讨了在不对称催化剂中有效建模催化剂选择性的2D描述器,克服了计算成本.
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