Dispersed polaron simulations of electron transfer in photosynthetic reaction centers

A Warshel, ZT Chu, WW Parson - Science, 1989 - science.org
A microscopic method for simulating quantum mechanical, nuclear tunneling effects in
biological electron transfer reactions is presented and applied to several electron transfer …

Protein dynamics control the kinetics of initial electron transfer in photosynthesis

H Wang, S Lin, JP Allen, JAC Williams, S Blankert… - Science, 2007 - science.org
The initial electron transfer dynamics during photosynthesis have been studied in
Rhodobacter sphaeroides reaction centers from wild type and 14 mutants in which the …

[PDF][PDF] Calculation of electron transfer reorganization energies using the finite difference Poisson-Boltzmann model

KA Sharp - Biophysical journal, 1998 - cell.com
A description is given of a method to calculate the electron transfer reorganization energy (λ)
in proteins using the linear or nonlinear Poisson-Boltzmann (PB) equation. Finite difference …

Coupling of protein motion to electron transfer in a photosynthetic reaction center: investigating the low temperature behavior in the framework of the spin—boson …

D Xu, K Schulten - Chemical physics, 1994 - Elsevier
The spin—boson model is applied to describe the coupling between protein motion and
electron transfer for the primary electron transfer in the photosynthetic reaction center of …

Electric field modulation of electron transfer reaction rates in isotropic systems: long distance charge recombination in photosynthetic reaction centers

S Franzen, RF Goldstein, SG Boxer - Journal of Physical …, 1990 - ACS Publications
A general method is demonstrated for experimentally obtaining the rate constant of electron
transfer as a function of the free energy of the reaction in nonoriented systems. An external …

Coupling of protein motion to electron transfer: Molecular dynamics and stochastic quantum mechanics study of photosynthetic reaction centers

K Schulten, M Tesch - Chemical Physics, 1991 - Elsevier
We investigate how electron transfer is controlled by protein motion in photosynthetic
reaction centers. Our study is based on molecular dynamics (MD) simulations of two electron …

[PDF][PDF] Temperature dependence of electron transfer between bacteriopheophytin and ubiquinone in protonated and deuterated reaction centers of …

CC Schenck, WW Parson, D Holten, MW Windsor… - Biophysical …, 1981 - cell.com
The rate of the electron-transfer reaction between bacteriopheophytin and the first quinone
in isolated reaction centers of Rhodopseudomonas sphaeroides has an unusual …

Simulating the dynamics of the primary charge separation process in bacterial photosynthesis

S Creighton, JK Hwang, A Warshel, WW Parson… - Biochemistry, 1988 - ACS Publications
Revised Manuscript Received December 4, 1987 abstract: The mechanism of the initial
electron-transfer process in thereaction centers of photosynthetic bacteria is examined by …

Computer simulations of electron-transfer reactions in solution and in photosynthetic reaction centers

A Warshel, WW Parson - Annual review of physical chemistry, 1991 - annualreviews.org
Studies of electron-transfer reactions, which have progressed rapidly on both the ex:
perimental and theoretical fronts, have been the subject of several reviews (1-5). Although …

Structure‐based analysis of the initial electron transfer step in bacterial photosynthesis: Electric field induced fluorescence anisotropy

DJ Lockhart, RF Goldstein, SG Boxer - The Journal of chemical physics, 1988 - pubs.aip.org
The fluorescence intensity from randomly oriented, immobilized R b. sphaeroides reaction
centers at 77 K increases in the presence of an externally applied electric field. We have …