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Molecular dynamics simulations in photosynthesis
Photosynthesis is regulated by a dynamic interplay between proteins, enzymes, pigments,
lipids, and cofactors that takes place on a large spatio-temporal scale. Molecular dynamics …
lipids, and cofactors that takes place on a large spatio-temporal scale. Molecular dynamics …
A perspective on the major light-harvesting complex dynamics under the effect of pH, salts, and the photoprotective PsbS protein
The photosynthetic apparatus is a highly modular assembly of large pigment-binding
proteins. Complexes called antennae can capture the sunlight and direct it from the …
proteins. Complexes called antennae can capture the sunlight and direct it from the …
Charge transfer from the carotenoid can quench chlorophyll excitation in antenna complexes of plants
The photosynthetic apparatus of higher plants can dissipate excess excitation energy during
high light exposure, by deactivating excited chlorophylls through a mechanism called …
high light exposure, by deactivating excited chlorophylls through a mechanism called …
Benchmark and performance of long-range corrected time-dependent density functional tight binding (LC-TD-DFTB) on rhodopsins and light-harvesting complexes
The chromophores of rhodopsins (Rh) and light-harvesting (LH) complexes still represent a
major challenge for a quantum chemical description due to their size and complex electronic …
major challenge for a quantum chemical description due to their size and complex electronic …
Multiscale QM/MM molecular dynamics simulations of the trimeric major light-harvesting complex II
Photosynthetic processes are driven by sunlight. Too little of it and the photosynthetic
machinery cannot produce the reductive power to drive the anabolic pathways. Too much …
machinery cannot produce the reductive power to drive the anabolic pathways. Too much …
How the pH controls photoprotection in the light-harvesting complex of mosses
In response to varying light conditions, light-harvesting complexes (LHCs) switch from a light-
harvesting state to a quenched state to protect the photosynthetic organism from excessive …
harvesting state to a quenched state to protect the photosynthetic organism from excessive …
Time-dependent atomistic simulations of the CP29 light-harvesting complex
Light harvesting as the first step in photosynthesis is of prime importance for life on earth. For
a theoretical description of photochemical processes during light harvesting, spectral …
a theoretical description of photochemical processes during light harvesting, spectral …
Robust strategy for photoprotection in the light-harvesting antenna of diatoms: a molecular dynamics study
Diatoms generate a large portion of the oxygen produced on earth due to their exceptional
light-harvesting properties involving fucoxanthin and chlorophyll-binding proteins (FCP). At …
light-harvesting properties involving fucoxanthin and chlorophyll-binding proteins (FCP). At …
Protein effects on the excitation energies and exciton dynamics of the CP24 antenna complex
P Sarngadharan, Y Holtkamp… - The Journal of Physical …, 2024 - ACS Publications
In this study, the site energy fluctuations, energy transfer dynamics, and some spectroscopic
properties of the minor light-harvesting complex CP24 in a membrane environment were …
properties of the minor light-harvesting complex CP24 in a membrane environment were …
Exploring regulatory roles of plant thylakoid-bound proteins involved in abiotic stress responses
Abiotic stress is triggered by unfavorable environments such as drought, severe heat, heavy
metals, soil saturation, high-intensity light, and high salinity. These, in turn greatly affect …
metals, soil saturation, high-intensity light, and high salinity. These, in turn greatly affect …