A multi-state fragment charge difference approach for diabatic states in electron transfer: Extension and automation
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4824906
Reference67 articles.
1. Electron transfers in chemistry and biology
2. Tunneling currents in electron transfer reactions in proteins
3. Electron-transfer reactions in proteins: an artificial intelligence approach to electronic coupling
4. Distance Dependence of Electron Transfer Across Peptides with Different Secondary Structures: The Role of Peptide Energetics and Electronic Coupling
5. Electronic coupling between Watson–Crick pairs for hole transfer and transport in desoxyribonucleic acid
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