Quantum Chemical Calculations with Machine Learning for Multipolar Electrostatics Prediction in RNA: An Application to Pentose

Yongna Yuan, Haoqiu Yan, Zeyang Cui, Zhenyu Liu, Wei Su, Ruisheng Zhang. Quantum Chemical Calculations with Machine Learning for Multipolar Electrostatics Prediction in RNA: An Application to Pentose. Journal of Chemical Information and Computer Sciences, 62(17):4122-4133, 2022. [doi]

Authors

Yongna Yuan

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Haoqiu Yan

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Zeyang Cui

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Zhenyu Liu

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Wei Su

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Ruisheng Zhang

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