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Theoretical study of CO escaping pathway in myoglobin with the 3D-RISM theory

Authors :
Kiyota, Yasuomi
Hiroaka, Ryusuke
Yoshida, Norio
Maruyama, Yutaka
Imai, Takashi
Hirata, Fumio
Source :
Journal of the American Chemical Society. March 25, 2009, Vol. 131 Issue 11, 3852-3853
Publication Year :
2009

Abstract

CO escaping pathways of Myoglobin are examined in terms of three-dimensional (3D) distribution function that is calculated by the 3D-RISM theory. The partial molar volume changes through the CO escaping pathways have agreed with those from the experiment.

Subjects

Subjects :
Carbon monoxide -- Chemical properties
Myoglobin -- Chemical properties
Myoglobin -- Structure
Chemistry

Details

Language :
English
ISSN :
00027863
Volume :
131
Issue :
11
Database :
Gale General OneFile
Journal :
Journal of the American Chemical Society
Publication Type :
Academic Journal
Accession number :
edsgcl.200351712

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