"Automated descriptor selection, volcano curve generation, and active site ..."

Xue Zong, Jonathan Lym, Dionisios G. Vlachos (2023)

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DOI: 10.1016/J.CPC.2023.108754

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type: Journal Article

metadata version: 2024-10-06

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Xue Zong, Jonathan Lym, Dionisios G. Vlachos:
Automated descriptor selection, volcano curve generation, and active site determination using the DescMAP software. Comput. Phys. Commun. 290: 108754 (2023)

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