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- Staemmler, Volker, et al. Show all 5 Authors
- Proceedings of the National Academy of Sciences of the United States of America 2007 v.104 no.52 pp. 20725-20730
- Anabaena; ambient temperature; hydrogen bonding; molecular dynamics
- ... A mixed quantum/classical investigation of the dynamical magnetostructural properties, that is, "magnetodynamics," of oxidized Anabaena PCC7119 ferredoxin is carried out at room temperature in two distinct conformational states. This protein hosts a [2Fe-2S] cluster in which two iron centers are antiferromagnetically coupled to an overall low-spin electronic ground state that has a genuine multire ...
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