Fragment Orbital Based Description of Charge Transfer in Peptides Including Backbone Orbitals
Heck, A., Woiczikowski, P., Kubar, T., Welke, K., Niehaus, Thomas A.
, Giese, B., Skourtis, S., Elstner, M. and make_name_string expected hash reference
(2014)
Fragment Orbital Based Description of Charge Transfer in Peptides Including Backbone Orbitals.
The Journal of Physical Chemistry B 118 (16), pp. 4261-4272.
Date of publication of this fulltext: 28 May 2014 11:35
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| Item type | Article | ||||
| Journal or Publication Title | The Journal of Physical Chemistry B | ||||
| Publisher: | AMER CHEMICAL SOC | ||||
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| Place of Publication: | WASHINGTON | ||||
| Volume: | 118 | ||||
| Number of Issue or Book Chapter: | 16 | ||||
| Page Range: | pp. 4261-4272 | ||||
| Date | 21 March 2014 | ||||
| Institutions | Physics > Institute of Theroretical Physics > Alumni or Retired Professors > Group Thomas Niehaus | ||||
| Identification Number |
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| Keywords | ELECTRON-TRANSFER REACTIONS; DENSITY-FUNCTIONAL THEORY; MOLECULAR MECHANICAL METHODS; CYTOCHROME-C-OXIDASE; AB-INITIO; HOLE TRANSFER; STRUCTURAL FLUCTUATIONS; BIOLOGICAL MOLECULES; MATRIX-ELEMENTS; QM/MM METHODS; | ||||
| Dewey Decimal Classification | 500 Science > 530 Physics | ||||
| Status | Published | ||||
| Refereed | Yes, this version has been refereed | ||||
| Created at the University of Regensburg | Yes | ||||
| Item ID | 30037 |
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