Pages that link to "Q30328514"

The following pages link to Geometry, reduction potential, and reorganization energy of the binuclear Cu(A) site, studied by density functional theory. (Q30328514):

Displaying 29 items.

• Alternative ground states enable pathway switching in biological electron transfer (Q28714216) (← links)
• NMR structure determination of proteins supplemented by quantum chemical calculations: detailed structure of the Ca2+ sites in the EGF34 fragment of protein S. (Q30350384) (← links)
• Electron transfer pathways in cytochrome c oxidase (Q30502350) (← links)
• Quantum chemical geometry optimizations in proteins using crystallographic raw data (Q30703663) (← links)
• Spectroscopic and Theoretical Study of Cu(I) Binding to His111 in the Human Prion Protein Fragment 106-115. (Q31050819) (← links)
• Accurate metal-site structures in proteins obtained by combining experimental data and quantum chemistry (Q33271330) (← links)
• Electronic structure and its relation to function in copper proteins (Q34662144) (← links)
• Quantum chemical calculations of spectroscopic properties of metalloproteins and model compounds: EPR and Mössbauer properties (Q35053354) (← links)
• Respiratory transformation of nitrous oxide (N2O) to dinitrogen by Bacteria and Archaea (Q36616961) (← links)
• Binuclear Cu(A) Formation in Biosynthetic Models of Cu(A) in Azurin Proceeds via a Novel Cu(Cys)2His Mononuclear Copper Intermediate (Q36927097) (← links)
• The role of ligand-containing loops at copper sites in proteins (Q37077329) (← links)
• Electronic structure of the ground and excited states of the Cu(A) site by NMR spectroscopy (Q37096996) (← links)
• Axial interactions in the mixed-valent CuA active site and role of the axial methionine in electron transfer (Q37157465) (← links)
• Cu(A) centers and their biosynthetic models in azurin (Q37695136) (← links)
• Metalloproteins containing cytochrome, iron-sulfur, or copper redox centers (Q37727718) (← links)
• Insights into Cu(I) exchange in HAH1 using quantum mechanical and molecular simulations (Q41907744) (← links)
• Theoretical study of the discrimination between O(2) and CO by myoglobin (Q44066719) (← links)
• Comparison of the Chemical Properties of Iron and Cobalt Porphyrins and Corrins (Q44436757) (← links)
• Theoretical studies on DNA-photocleavage efficiencies of Ru(II) polypyridyl complexes (Q44503245) (← links)
• Density functional theory of the CuA -like Cu2 S2 diamond core in Cu 2II(NGuaS)2 Cl2. (Q46605880) (← links)
• Reversible Switching of Redox-Active Molecular Orbitals and Electron Transfer Pathways in Cu(A) Sites of Cytochrome c Oxidase. (Q46708614) (← links)
• Walking the seven lines: binuclear copper A in cytochrome c oxidase and nitrous oxide reductase (Q47686689) (← links)
• Importance of polarization effect in the study of metalloproteins: application of polarized protein specific charge scheme in predicting the reduction potential of azurin (Q51092685) (← links)
• The medium reorganization energy for the charge transfer reactions in proteins (Q51546151) (← links)
• Control of the Electronic Ground State on an Electron-Transfer Copper Site by Second-Sphere Perturbations (Q57655824) (← links)
• Influence of the Copper Coordination Geometry on the DNA Cleavage Activity of Clip-Phen Complexes Studied by DFT (Q59457677) (← links)
• Dramatic Electronic Perturbations of CuA Centers via Subtle Geometric Changes. (Q64905649) (← links)
• Theoretical studies on DNA-photocleavage efficiencies and mechanisms of Ru(II) polypyridyl complexes (Q84814876) (← links)
• Is it possible for Fe2+ to approach protoporphyrin IX from the side of Tyr-13 in Bacillus subtilis ferrochelatase? An answer from QM/MM study (Q85267923) (← links)