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MOESM8 of Machine learning models for hydrogen bond donor and acceptor strengths using large and diverse training data generated by first-principles interaction free energies

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Figshare2019-12-06 更新2026-04-08 收录
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https://springernature.figshare.com/articles/MOESM8_of_Machine_learning_models_for_hydrogen_bond_donor_and_acceptor_strengths_using_large_and_diverse_training_data_generated_by_first-principles_interaction_free_energies/9809729/1
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Additional file 8. Source code for training the HBA and HBD models and two example molecules.
创建时间:
2019-09-12
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