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ChemistryMedicine

Towards quantitative analysis of intermolecular interactions with Hirshfeld surfaces.

J. J. McKinnon, D. Jayatilaka, M. Spackman

2007.9.18CHEMICAL COMMUNICATIONS

DOI: 10.1039/b704980c

tlooto Summary

Enhancements to the properties based on Hirshfeld surfaces enable quantitative comparisons between contributions to crystal packing from various types of intermolecular contacts.

Abstract

Enhancements to the properties based on Hirshfeld surfaces enable quantitative comparisons between contributions to crystal packing from various types of intermolecular contacts.

Citation format

MCKINNON, J. J.; JAYATILAKA, D.; SPACKMAN, M. Towards quantitative analysis of intermolecular interactions with hirshfeld surfaces. CHEMICAL COMMUNICATIONS, 2007, 37: 3814–6.