Evidence map›Paper›PMID 40584384›Full record

ArticleACS omega2025

Simulations of Excitonic Couplings in Spinach Light-Harvesting Complex II Using a More Realistic Model in the Presence of Photosystem II Core.

Bin-Bin Xie, Bo-Wen Yin, Pei-Ke Jia, Hai-Feng Li, Liang Peng, Lin Shen, Wei-Hai Fang

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Article in ACS omega, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

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0citing papers in PubMed
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1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

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Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

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0 citing papers in PubMed.

No citing paper in PubMed yet.

4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

7 authors.

Bin-Bin XieHangzhou Institute of Advanced Studies, Zhejiang Normal University, 1108 Gengwen Road, Hangzhou 311231, Zhejiang, P. R. China.ORCID https://orcid.org/0000-0002-5347-2795
Bo-Wen YinKey Laboratory of Theoretical and Computational Photochemistry of Ministry of Education, College of Chemistry, Beijing Normal University, Beijing 100875, P. R. China.ORCID https://orcid.org/0000-0002-4213-5697
Pei-Ke JiaHangzhou Institute of Advanced Studies, Zhejiang Normal University, 1108 Gengwen Road, Hangzhou 311231, Zhejiang, P. R. China.
Hai-Feng LiSchool of Science, Xi'an Technological University, Xi'an 710021, P. R. China.
Liang PengGuangdong Provincial Key Laboratory of Chemical Pollution and Environmental Safety & MOE Key Laboratory of Theoretical Chemistry of Environment, School of Environment, South China Normal University, Guangzhou 510006, P. R. China.
Lin ShenKey Laboratory of Theoretical and Computational Photochemistry of Ministry of Education, College of Chemistry, Beijing Normal University, Beijing 100875, P. R. China.ORCID https://orcid.org/0000-0001-6878-8963
Wei-Hai FangKey Laboratory of Theoretical and Computational Photochemistry of Ministry of Education, College of Chemistry, Beijing Normal University, Beijing 100875, P. R. China.ORCID https://orcid.org/0000-0002-1668-465X

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

In this study, we employed a method for evaluating dynamic exciton couplings by using atomic transition density moments and molecular dynamics (MD) coordinates. We then applied this computational approach to investigate protein-regulated exciton couplings in spinach light-harvesting complex II (LHCII). Our findings, based on a more realistic all-atom computational model in the presence of the photosystem II (PSII) core and minor antennas, reveal distinct coupling strength patterns for the monomers in LHCII. The probability distributions of excitonic couplings in isolated LHCII always exhibit a single peak, whereas those in the LHCII-PSII complex display a bimodal nature. Such reductions in the excitonic coupling strengths of the main pigments, especially for some chlorophyll-lutein pairs, suggest that the peripheral proteins could modulate energy transfer processes in LHCII-PSII. A closer examination of the key structural parameters reveals that the angles between helices A and B and the distance between CLA612 and LUT620 increase in LHCII-PSII, which are closely associated with the reductions in excitonic couplings.

Identifiers

PMID40584384
PMCPMC12199089

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.