"Alignment-Free Molecular Shape Comparison Using Spectral Geometry: The ..."

Matthew P. Seddon et al. (2019)

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DOI: 10.1021/ACS.JCIM.8B00676

access: closed

type: Journal Article

metadata version: 2021-06-01

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Matthew P. Seddon, David A. Cosgrove, Martin J. Packer, Valerie J. Gillet:
Alignment-Free Molecular Shape Comparison Using Spectral Geometry: The Framework. J. Chem. Inf. Model. 59(1): 98-116 (2019)

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