作者：Pal Rajat Kumar; Haider Kamran; Kaur Divya; Flynn William; Xia Junchao; Levy Ronald M; Taran Tetiana; Wickstrom Lauren; Kurtzman Tom; Gallicchio Emilio*
来源：Journal of Computer-Aided Molecular Design, 2017, 31(1): 45-45.
DOI：10.1007/s10822-016-9987-z
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