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Journal: Molecules, 2018
Volume: 23
Number: 2487
Article:
Efficient Computation of Free Energy Surfaces of Diels–Alder Reactions in Explicit Solvent at Ab Initio QM/MM Level
Authors:
by
Pengfei Li, Fengjiao Liu, Xiangyu Jia, Yihan Shao, Wenxin Hu, Jun Zheng and Ye Mei
Link:
https://www.mdpi.com/1420-3049/23/10/2487
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