机器学习在材料研发中的应用 |
谢建新, 宿彦京, 薛德祯, 姜雪, 付华栋, 黄海友 |
Machine Learning for Materials Research and Development |
XIE Jianxin, SU Yanjing, XUE Dezhen, JIANG Xue, FU Huadong, HUANG Haiyou |
图12 编码与解码设计流程[ |
Fig.12 The materials reverse design process by encoding and decoding (SMILES—simplified molecular-input line-entry system)[ |
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