FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2067930799> ?p ?o ?g. }

• W2067930799 endingPage "3495" @default.
• W2067930799 startingPage "3488" @default.
• W2067930799 abstract "The Fenna-Matthews-Oslon (FMO) light harvesting pigment-protein complex in green sulfur bacteria transfers the excitation energy from absorbed sunlight to the reaction center with almost 100% quantum efficiency. The protein-pigment coupling (part of the environmental effects) is believed to play an important role in determining excitation energy transfer pathways. To study the effect of environment on the electronic transitions in the FMO complex, especially by taking into account the newly discovered eighth extra pigment, we have employed hybrid quantum-mechanics/molecular-mechanics (QM/MM) methods in combination with molecular dynamics (MD) simulations. The averaged site energies of individual pigments are calculated using the semiempirical ZINDO/S-CIS method considering the protein residues as atomic point charges along the MD trajectories. The exciton energies are calculated from the site energies and excitonic couplings based on MD simulations. The new eighth pigment displays the largest site energy and contributes mainly to the highest exciton level, which may facilitate transfer of excitation energies from the baseplate to the reaction center. Further, the multimode Brownian oscillator (MBO) model is used to fit the linear absorption spectra of the FMO complex, validating the exciton energies obtained from the QM/MM calculations. Our results indicate that the QM/MM method combined with MD simulations is a powerful tool to model the environmental effects on electronic transitions of light harvesting antenna complexes." @default.
• W2067930799 created "2016-06-24" @default.
• W2067930799 creator A5048588199 @default.
• W2067930799 creator A5056056743 @default.
• W2067930799 creator A5071068135 @default.
• W2067930799 creator A5084985646 @default.
• W2067930799 creator A5086455686 @default.
• W2067930799 creator A5088063692 @default.
• W2067930799 date "2013-03-26" @default.
• W2067930799 modified "2023-10-16" @default.
• W2067930799 title "QM/MM Modeling of Environmental Effects on Electronic Transitions of the FMO Complex" @default.
• W2067930799 cites W1576724039 @default.
• W2067930799 cites W1805686156 @default.
• W2067930799 cites W1964897817 @default.
• W2067930799 cites W1966689114 @default.
• W2067930799 cites W1971052325 @default.
• W2067930799 cites W1971370046 @default.
• W2067930799 cites W1977825086 @default.
• W2067930799 cites W1981194820 @default.
• W2067930799 cites W1982645807 @default.
• W2067930799 cites W1982972906 @default.
• W2067930799 cites W1994115643 @default.
• W2067930799 cites W2019403673 @default.
• W2067930799 cites W2023813727 @default.
• W2067930799 cites W2023972714 @default.
• W2067930799 cites W2026766829 @default.
• W2067930799 cites W2027408247 @default.
• W2067930799 cites W2029667189 @default.
• W2067930799 cites W2030104505 @default.
• W2067930799 cites W2032100925 @default.
• W2067930799 cites W2032329779 @default.
• W2067930799 cites W2035838814 @default.
• W2067930799 cites W2041920447 @default.
• W2067930799 cites W2042487980 @default.
• W2067930799 cites W2043638827 @default.
• W2067930799 cites W2045345626 @default.
• W2067930799 cites W2045664105 @default.
• W2067930799 cites W2048866816 @default.
• W2067930799 cites W2050333027 @default.
• W2067930799 cites W2058468006 @default.
• W2067930799 cites W2060234842 @default.
• W2067930799 cites W2063435604 @default.
• W2067930799 cites W2076502184 @default.
• W2067930799 cites W2090106994 @default.
• W2067930799 cites W2091882305 @default.
• W2067930799 cites W2102080148 @default.
• W2067930799 cites W2106140689 @default.
• W2067930799 cites W2118881986 @default.
• W2067930799 cites W2145838318 @default.
• W2067930799 cites W2148425143 @default.
• W2067930799 cites W2150508478 @default.
• W2067930799 cites W2150852355 @default.
• W2067930799 cites W2150981663 @default.
• W2067930799 cites W2171093931 @default.
• W2067930799 cites W2314969497 @default.
• W2067930799 cites W2326506907 @default.
• W2067930799 cites W379702399 @default.
• W2067930799 doi "https://doi.org/10.1021/jp3109418" @default.
• W2067930799 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/23480507" @default.
• W2067930799 hasPublicationYear "2013" @default.
• W2067930799 type Work @default.
• W2067930799 sameAs 2067930799 @default.
• W2067930799 citedByCount "52" @default.
• W2067930799 countsByYear W20679307992014 @default.
• W2067930799 countsByYear W20679307992015 @default.
• W2067930799 countsByYear W20679307992016 @default.
• W2067930799 countsByYear W20679307992017 @default.
• W2067930799 countsByYear W20679307992018 @default.
• W2067930799 countsByYear W20679307992019 @default.
• W2067930799 countsByYear W20679307992020 @default.
• W2067930799 countsByYear W20679307992021 @default.
• W2067930799 countsByYear W20679307992022 @default.
• W2067930799 countsByYear W20679307992023 @default.
• W2067930799 crossrefType "journal-article" @default.
• W2067930799 hasAuthorship W2067930799A5048588199 @default.
• W2067930799 hasAuthorship W2067930799A5056056743 @default.
• W2067930799 hasAuthorship W2067930799A5071068135 @default.
• W2067930799 hasAuthorship W2067930799A5084985646 @default.
• W2067930799 hasAuthorship W2067930799A5086455686 @default.
• W2067930799 hasAuthorship W2067930799A5088063692 @default.
• W2067930799 hasConcept C121332964 @default.
• W2067930799 hasConcept C123669783 @default.
• W2067930799 hasConcept C147597530 @default.
• W2067930799 hasConcept C147789679 @default.
• W2067930799 hasConcept C159467904 @default.
• W2067930799 hasConcept C17729963 @default.
• W2067930799 hasConcept C178790620 @default.
• W2067930799 hasConcept C184779094 @default.
• W2067930799 hasConcept C185592680 @default.
• W2067930799 hasConcept C188231169 @default.
• W2067930799 hasConcept C20803032 @default.
• W2067930799 hasConcept C2778627677 @default.
• W2067930799 hasConcept C32909587 @default.
• W2067930799 hasConcept C41999313 @default.
• W2067930799 hasConcept C59593255 @default.
• W2067930799 hasConcept C62520636 @default.
• W2067930799 hasConcept C83581075 @default.
• W2067930799 hasConceptScore W2067930799C121332964 @default.

• next