Lorenzo Cupellini - Publications, H-index & Citations

Lorenzo Cupellini

università di pisa

30H指数

164论文数

2.8K被引数

收录论文 60

发表时间

Vibronic Reorganization Suppresses Salinixanthin-to-Retinal Energy Transfer in the Freshwater Kin4B8 Xanthorhodopsin 振子重排抑制淡水菌视紫红质Kin4B8中盐藻黄素向视黄醛的能量转移

The Journal of Physical Chemistry Letters

IF0

2026-04-07

OAAI

Giacomo Salvadori; Piermarco Saraceno; Chris John; Lorenzo Cupellini; Laura Pedraza-González

An Efficient PCM Scheme for ESA Oscillator Strengths within the Unrelaxed TD-DFT Approximation 在非松弛TD-DFT近似下的ESA振荡强度的高效PCM方案

Journal of Chemical Theory and Computation

IF5.5

2026-03-31

PREAI

Jakub Širůček; Boris Le Guennic; Denis Jacquemin; Benedetta Mennucci; Lorenzo Cupellini

Multiscale Machine Learning Prediction of Infrared Spectra of Solvated Molecules 多尺度机器学习预测溶剂化分子的红外光谱

Journal of Chemical Theory and Computation

IF5.5

2026-02-11

OAAI

Patrizia Mazzeo; Lorenzo Cupellini; Benedetta Mennucci

Quantum chemical modeling of energy flow and photoprotection in photosystem II 量子化学模拟光合系统II中的能量流动与光保护

Cell Reports Physical Science

IF7.3

2026-02-09

OAAI

Elena Betti; Lorenzo Cupellini; Benedetta Mennucci

Machine-Learning Framework for Excitation Energies of Chromophores in Polarizable Environments 可极化环境中发色团激发能的机器学习框架

Journal of Chemical Information and Modeling

IF5.3

2026-01-31

PREAI

Chris John; Edoardo Cignoni; Lorenzo Cupellini; Benedetta Mennucci

Exciton Delocalization Promotes Far-Red Absorption in a Tetrameric Chlorophyll a Light-Harvesting Complex from Trachydiscus minutus Trachydiscus minutus来源的四聚体叶绿素a天线复合体中，激子离域化促进远红光吸收。

Journal of the American Chemical Society

IF15.6

2025-12-13

OAAI

Soichiro Seki; Lorenzo Cupellini; David Bína; Elena Betti; Petra Urajová; Hideaki Tanaka; Tomoko Miyata; Keiichi Namba; Genji Kurisu; Tomáš Polívka; Radek Litvín; Ritsuko Fujii

How Dispersion Interactions at the Excited State Can Tune Photochromism of Embedded Chromophores 激发态下的色散相互作用如何调节嵌入的发色团的光致变色

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2025-12-01

PREAI

Guido, Ciro A.; Cupellini, Lorenzo; Mennucci, Benedetta; Curutchet, Carles

Shortcomings of Linear-Response TD-DFT for ESA Oscillator Strength Calculations

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2025-12-01

PREAI

Sirucek, Jakub; Le Guennic, Boris; Cupellini, Lorenzo; Jacquemin, Denis

Quantum Dynamics Simulations Reveal Ultrafast and Coherent Charge Transfer in the Lhca4 Antenna of Photosystem I

JOURNAL OF PHYSICAL CHEMISTRY LETTERS

IF4.6

2025-12-01

PREAI

Saraceno, Piermarco; Santoro, Fabrizio; Cupellini, Lorenzo

Theory of photosynthetic membrane influence on B800-B850 energy transfer in the LH2 complex 光合膜对LH2复合体中B800-B850能量转移的影响理论

Biophysical Journal

IF3.1

2025-10-30

OAAI

Chawntell Kulkarni; Hallmann Óskar Gestsson; Lorenzo Cupellini; Benedetta Mennucci; Alexandra Olaya-Castro

Structural determinants for red-shifted absorption in higher-plants Photosystem I 高等植物光合系统I中红移吸收的结构决定因素

New Phytologist

IF8.1

2025-09-15

OAAI

Stefano Capaldi; Zeno Guardini; Daniele Montepietra; Vittorio Flavio Pagliuca; Antonello Amelii; Elena Betti; Chris John; Laura Pedraza-González; Lorenzo Cupellini; Benedetta Mennucci; Diane Marie Valerie Bonnet; Antonio Chaves-Sanjuan; Luca Dall'Osto; Roberto Bassi

Origins of curvature in meso-tetra(4-sulfonatophenyl) porphine aggregation: molecular dynamics and electronic spectroscopy 介肼四(4-磺酸苯基)卟啉聚集体的曲率起源：分子动力学与电子光谱学

Mol. Syst. Des. Eng.

IF3.2

2025-08-05

OAAI

Laura Baliulyte; Eimantas Urniezius; Vytautas Bubilaitis; Mindaugas Macernis; Lorenzo Cupellini; Darius Abramavicius

Theory of photosynthetic membrane influence on B800-B850 energy transfer in the LH2 complex

BIOPHYSICAL JOURNAL

IF3.1

2025-01-01

OAAI

Kulkarni, Chawntell; Gestsson, Hallmann Oskar; Cupellini, Lorenzo; Mennucci, Benedetta; Olaya-Castro, Alexandra

Protein-Driven Electron-Transfer Process in a Fatty Acid Photodecarboxylase

JACS AU

IF8.7

2024-12-18

OAAI

Londi, Giacomo; Salvadori, Giacomo; Mazzeo, Patrizia; Cupellini, Lorenzo; Mennucci, Benedetta

Theoretical description of photoinduced electron transfer in donor-acceptor supramolecular complexes based on carbon buckybowls

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-07-02

PREAI

Rubert-Albiol, Raquel; Cerda, Jesus; Calbo, Joaquin; Cupellini, Lorenzo; Orti, Enrique; Arago, Juan

Exciton transport in molecular organic semiconductors boosted by transient quantum delocalization (vol 13, 2755, 2022)

NATURE COMMUNICATIONS

IF15.7

2024-04-11

OAAI

Giannini, Samuele; Peng, Wei-Tao; Cupellini, Lorenzo; Padula, Daniele; Carof, Antoine; Blumberger, Jochen

Structural and quantum chemical basis for OCP-mediated quenching of phycobilisomes

SCIENCE ADVANCES

IF12.5

2024-04-05

OAAI

Sauer, Paul V.; Cupellini, Lorenzo; Sutter, Markus; Bondanza, Mattia; Martin, Maria Agustina Dominguez; Kirst, Henning; Bina, David; Koh, Adrian Fujiet; Kotecha, Abhay; Greber, Basil J.; Nogales, Eva; Polivka, Tomas; Mennucci, Benedetta; Kerfeld, Cheryl A.

The OpenMMPol library for polarizable QM/MM calculations of properties and dynamics OpenMMPol库，用于可极化QM/MM的性质和动力学计算

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-04-01

OAAI

Bondanza, Mattia; Nottoli, Tommaso; Nottoli, Michele; Cupellini, Lorenzo; Lipparini, Filippo; Mennucci, Benedetta

Electronic Excited States from Physically Constrained Machine Learning 来自物理约束机器学习的电子激发态

ACS CENTRAL SCIENCE

IF10.4

2024-02-29

OAAI

Cignoni, Edoardo; Suman, Divya; Nigam, Jigyasa; Cupellini, Lorenzo; Mennucci, Benedetta; Ceriotti, Michele