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A molecular packing analysis of some ferrous porphyrin complexes

✍ Scribed by David Hall; K. Barry Sexton

Publisher
John Wiley and Sons
Year
1982
Tongue
English
Weight
460 KB
Volume
3
Category
Article
ISSN
0192-8651

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✦ Synopsis

Abstract

An analysis has been made of the applicability of various sets of nonbonded interaction potential parameters which do not consider hydrogen atoms explicitly, to represent molecular packing interactions in crystals of ferrous porphyrin complexes, which are models for deoxyhemoglobin. Ordered regions of the structures are well described, but disordered solvent or ligands cause difficulty.

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