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Manuscript title: On the Structure and Reaction Mechanism of Human Acireductone Dioxygenase

Journal: Chem. Eur. J.

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DC FieldValueLanguage
dc.contributor.authorBorowski, Tomasz-
dc.coverage.spatialES Girona Girona-
dc.date.accessioned2017-10-30T10:54:17Z-
dc.date.available2017-10-30T10:54:17Z-
dc.date.created2017-10-30T11:54:15.473+01:00-
dc.date.issued2017-10-30T11:54:15.473+01:00-
dc.identifier.urihttps://iochem.udg.edu:8443/browse/handle/100/380-
dc.descriptionmodel for ACI bound to Fe(II) via O1 and O3, H88 dissociated from Fe; ONIOM Opt-
dc.publisherUdG-
dc.relationOriginal title: On the Structure and Reaction Mechanism of Human Acireductone Dioxygenase Journal: Chem. Eur. J.*
dc.rightsCC BY 4.0 (c) UdG, 2017-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.titleM4-
dc.typedataset-
dc.date.updated2017-10-30T10:54:17Z-
cml.program.nameGaussianen
cml.program.version09en
cml.program.otherEM64L-G09RevD.01en
cml.methodONIOMen
cml.methodB3LYPen
cml.methodAMBERen
cml.spintypeen
cml.calculationtypeSingle point Structureen
cml.hassolventfalseen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Fe-hARD_Mossbauer - DOI: 10.19061/iochem-bd-4-4



Please use this identifier to cite or link to this item: https://iochem.udg.edu:8443/browse/handle/100/380

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