logo
科言猫学术研究的AI总结
language
手机端手机端
  • Phone Feature微信小程序
简体中文简体中文
notice消息通知
博客博客
delete
arrow
返回
C

Carles Curutchet

University of Barcelona

39H指数
113论文数
4.9K被引数
收录论文 45
发表时间
logo
Unraveling Charge-Transfer States and Their Ultrafast Dynamics in Artificial Light-Harvesting Complexes人工光捕获复合物中的电荷转移态及其超快动力学
errACS PHYSICAL CHEMISTRY AU
IF4.3
err2026-01-01
err0
PREAI
errTeixeira Alves Duarte, Luis Gustavo; Lamas, Iker; Bauerle, Dominik; Shareef, Saeed; Cunha, Renato D.; Curutchet, Carles; Curti, Mariano; Romero, Elisabet
err分享
err收藏
The (Anti)aromatic Properties of Cyclo[n]Carbons: Myth or Reality?环[n]碳的(反)芳香性：神话还是现实？
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2025-12-05
err0
errOAAI
errStasyuk, O. A.; George, G.; Curutchet, C.; Plasser, F.; Stasyuk, A. J.
err分享
err收藏
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
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2025-12-01
err0
PREAI
errGuido, Ciro A.; Cupellini, Lorenzo; Mennucci, Benedetta; Curutchet, Carles
err分享
err收藏
Characterization of Ligand Binding in Human Serum Albumin from Atomistic Energy Transfer Simulations人血清白蛋白配体结合的表征：基于原子级能量转移模拟
errSMALL METHODS
IF9.1
err2025-11-01
err0
errOAAI
errErgun, Ozge; Bertran-Mostazo, Andrea; Cubero, Elena; Galdeano, Carles; Curutchet, Carles
err分享
err收藏
Mechanical Strain-Controlled Aromaticity in Cyclo[n]Carbons机械应变控制的环[n]碳芳香性
errChemistry – A European Journal
IF0
err2025-07-25
err0
errOAAI
errDr. O. A. Stasyuk; Prof. Dr. C. Curutchet; Dr. A. J. Stasyuk
err分享
err收藏
Improved Description of Environment and Vibronic Effects with Electrostatically Embedded ML Potentials静电嵌入机器学习势能对环境和振子-电子耦合效应的改进描述
errJOURNAL OF PHYSICAL CHEMISTRY LETTERS
IF4.6
err2025-01-13
err1
PREAI
errZinovjev, K; Curutchet, C
err分享
err收藏
Extending the MST Model to Large Biomolecular Systems: Parametrization of the ddCOSMO-MST Continuum Solvation Model
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2025-01-11
err0
PREAI
errCunha, R. D.; Romero-Tellez, S.; Lipparini, F.; Luque, F. J.; Curutchet, C.
err分享
err收藏
Enumerative Discovery of Noncanonical Polypeptide Secondary Structures非规范多肽二级结构的枚举发现
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2024-09-04
err0
errOAAI
errMoyer, Adam P.; Ramelot, Theresa A.; Curti, Mariano; Eastman, Margaret A.; Kang, Alex; Bera, Asim K.; Tejero, Roberto; Salveson, Patrick J.; Curutchet, Carles; Romero, Elisabet; Montelione, Gaetano T.; Baker, David
err分享
err收藏
Unraveling the role of thermal fluctuations on the exciton structure of the cryptophyte PC612 and PC645 photosynthetic antenna complexes解开热波动对隐藻PC612和PC645光合天线复合物的激子结构的作用
errFRONTIERS IN MOLECULAR BIOSCIENCES
IF4
err2023-09-18
err2
errOAAI
errOzaydin, Beste; Curutchet, Carles
err分享
err收藏
QM/AMOEBA description of properties and dynamics of embedded molecules嵌入分子的性质和动力学的QM/阿米巴描述
errWILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
IF27
err2023-06-08
err14
errOAAI
errNottoli, Michele; Bondanza, Mattia; Mazzeo, Patrizia; Cupellini, Lorenzo; Curutchet, Carles; Loco, Daniele; Lagardere, Louis; Piquemal, Jean-Philip; Mennucci, Benedetta; Lipparini, Filippo
err分享
err收藏
Prediction of n-octanol/water partition coefficients and acidity constants (pKa) in the SAMPL7 blind challenge with the IEFPCM-MST model用iefpcm-mst模型预测SAMPL7盲挑战中的正辛醇/水分配系数和酸度常数 (pKa)
errJOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
IF3.1
err2021-07-10
err10
errOAAI
errViayna, Antonio; Pinheiro, Silvana; Curutchet, Carles; Javier Luque, F.; Zamora, William J.
err分享
err收藏
Prediction of the n-octanol/water partition coefficients in the SAMPL6 blind challenge from MST continuum solvation calculations通过MST连续溶剂化计算预测sample6盲挑战中的正辛醇/水分配系数
errJOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
IF3.1
err2019-11-27
err11
PREAI
errZamora, William J.; Pinheiro, Silvana; German, Kilian; Rafols, Clara; Curutchet, Carles; Javier Luque, F.
err分享
err收藏
Electronic energy transfer in biomacromolecules生物大分子中的电子能量传递
errWILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
IF27
err2018-09-13
err34
errOAAI
errCupellini, Lorenzo; Corbella, Marina; Mennucci, Benedetta; Curutchet, Carles
err分享
err收藏
Density-Dependent Formulation of Dispersion-Repulsion Interactions in Hybrid Multiscale Quantum/Molecular Mechanics (QM/MM) Models混合多尺度量子/分子力学 (QM/MM) 模型中色散-排斥相互作用的密度依赖性公式
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2018-02-13
err28
errOAAI
errCurutchet, Carles; Cupellini, Lorenzo; Kongsted, Jacob; Corni, Stefano; Frediani, Luca; Steindal, Arnfinn Hykkerud; Guido, Ciro A.; Scalmani, Giovanni; Mennucci, Benedetta
err分享
err收藏
Theoretical Characterization of the Spectral Density of the Water-Soluble Chlorophyll-Binding Protein from Combined Quantum Mechanics/Molecular Mechanics Molecular Dynamics Simulations结合量子力学/分子力学分子动力学模拟的水溶性叶绿素结合蛋白光谱密度的理论表征
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2015-11-23
err65
errOAAI
errRosnik, Andreana M.; Curutchet, Carles
err分享
err收藏
Electronic Couplings for Resonance Energy Transfer from CCSD Calculations: From Isolated to Solvated Systems
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2015-10-28
err14
errOAAI
errCaricato, Marco; Curutchet, Caries; Mennucci, Benedetta; Scalmani, Giovanni
err分享
err收藏
Chromophore-Protein Coupling beyond Nonpolarizable Models: Understanding Absorption in Green Fluorescent Protein
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2015-09-16
err65
errOAAI
errDaday, Csaba; Curutchet, Caries; Sinicropi, Adalgisa; Mennucci, Benedetta; Filippi, Claudia
err分享
err收藏
Transferability and additivity of dihedral parameters in polarizable and nonpolarizable empirical force fields可极化和不可极化经验力场中二面角参数的可传递性和可加性
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2015-07-30
err15
PREAI
errZgarbova, Marie; Rosnik, Andreana M.; Javier Luque, F.; Curutchet, Carles; Jurecka, Petr
err分享
err收藏
Polarizable QM/MM Multiconfiguration Self-Consistent Field Approach with State-Specific Corrections: Environment Effects on Cytosine Absorption Spectrum具有状态特定校正的可极化QM/MM多配置自洽场方法: 环境对胞嘧啶吸收光谱的影响
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2015-03-04
err47
errOAAI
errLi, Quansong; Mennucci, Benedetta; Robb, Michael A.; Blancafort, Lluis; Curutchet, Carles
err分享
err收藏
Geometry Optimization in Polarizable QM/MM Models: The Induced Dipole Formulation可极化QM/MM模型中的几何优化: 诱导偶极子公式
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2014-03-21
err60
errOAAI
errCaprasecca, Stefano; Jurinovich, Sandro; Viani, Lucas; Curutchet, Carles; Mennucci, Benedetta
err分享
err收藏

研究方向

暂时未获取到该数据
合作学者
合作期刊
D
Donald G. Truhlar
H 指数: 187 · 论文数: 1.9K
A
Alex Zunger
H 指数: 147 · 论文数: 1.1K
C
Christopher J. Cramer
H 指数: 110 · 论文数: 864
D
David Beljonne
H 指数: 109 · 论文数: 837
V
Vincenzo Barone
H 指数: 106 · 论文数: 1.2K
查看更多