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A scalable and integrated machine learning framework for molecular properties prediction |
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| Authors: | Guzhong Chen Zhen Song Zhiwen Qi Kai Sundmacher |
| Affiliation: | 1. State Key Laboratory of Chemical Engineering, School of Chemical Engineering, East China University of Science and Technology, Shanghai, China;2. Process Systems Engineering, Max Planck Institute for Dynamics of Complex Technical Systems, Magdeburg, Germany |
| Abstract: | |
| Keywords: | flash point temperature machine learning melting temperature molecular property prediction octanol–water partition coefficient |