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María del Carmen Marín, PhD
María del Carmen Marín, PhD
在 campus.technion.ac.il 的电子邮件经过验证 - 首页
标题
引用次数
引用次数
年份
Toward automatic rhodopsin modeling as a tool for high-throughput computational photobiology
F Melaccio, M del Carmen Marín, A Valentini, F Montisci, S Rinaldi, ...
Journal of chemical theory and computation 12 (12), 6020-6034, 2016
692016
Red-shifting mutation of light-driven sodium-pump rhodopsin
K Inoue, M del Carmen Marín, S Tomida, R Nakamura, Y Nakajima, ...
Nature communications 10 (1), 1993, 2019
672019
a-ARM: Automatic Rhodopsin Modeling with Chromophore Cavity Generation, Ionization State Selection, and External Counterion Placement
L Pedraza-González, L De Vico, MC Marı́n, F Fanelli, M Olivucci
Journal of chemical theory and computation 15 (5), 3134-3152, 2019
452019
Fluorescence enhancement of a microbial rhodopsin via electronic reprogramming
MC Marín, D Agathangelou, Y Orozco-Gonzalez, A Valentini, Y Kato, ...
Journal of the American Chemical Society 141 (1), 262-271, 2018
442018
An average solvent electrostatic configuration protocol for Qm/mm free energy optimization: Implementation and application to rhodopsin systems
Y Orozco-Gonzalez, M Manathunga, MDC Marín, D Agathangelou, ...
Journal of chemical theory and computation 13 (12), 6391-6404, 2017
392017
Effect of point mutations on the ultrafast photo-isomerization of Anabaena sensory rhodopsin
D Agathangelou, Y Orozco-Gonzalez, M del Carmen Marín, PP Roy, ...
Faraday discussions 207, 55-75, 2018
172018
Assessment of MC-PDFT excitation energies for a set of QM/MM models of rhodopsins
MC Marín, L De Vico, SS Dong, L Gagliardi, DG Truhlar, M Olivucci
Journal of chemical theory and computation 15 (3), 1915-1923, 2019
162019
Web-ARM: A Web-Based Interface for the Automatic Construction of QM/MM Models of Rhodopsins
L Pedraza-González, MDC Marin, AN Jorge, TD Ruck, X Yang, ...
Journal of Chemical Information and Modeling 60 (3), 1481-1493, 2020
152020
Systematic excited state studies of reversibly switchable fluorescent proteins
D Smyrnova, MDC Marín, M Olivucci, A Ceulemans
Journal of chemical theory and computation 14 (6), 3163-3172, 2018
102018
Electrochemical behavior of hybrid carbon nanomaterials: the chemistry behind electrochemistry
M Moreno-Guzman, A Martín, M del Carmen Marín, T Sierra, ...
Electrochimica Acta 214, 286-294, 2016
102016
Sub-picosecond CC bond photo-isomerization: evidence for the role of excited state mixing
D Agathangelou, PP Roy, M del Carmen Marín, N Ferré, M Olivucci, ...
Comptes Rendus. Physique 22 (S2), 111-138, 2021
62021
Structural characterization of proton-pumping rhodopsin lacking a cytoplasmic proton donor residue by X-ray crystallography
K Suzuki, M del Carmen Marín, M Konno, R Bagherzadeh, T Murata, ...
Journal of Biological Chemistry 298 (3), 2022
52022
On the Automatic Construction of QM/MM Models for Biological Photoreceptors: Rhodopsins as Model Systems
L Pedraza-González, M del Carmen Marín, L De Vico, X Yang, M Olivucci
QM/MM Studies of Light-responsive Biological Systems, 1-75, 2020
52020
Multiple roles of a conserved glutamate residue for unique biophysical properties in a new group of microbial rhodopsins homologous to TAT rhodopsin
K Mannen, T Nagata, A Rozenberg, M Konno, M del Carmen Marín, ...
Journal of Molecular Biology, 168331, 2023
32023
Biophysical characterization of microbial rhodopsins with DSE motif
M del Carmen Marín, AL Jaffe, PT West, M Konno, JF Banfield, K Inoue
Biophysics and Physicobiology 20 (Supplemental), e201023, 2023
32023
Converting a Natural-Light-Driven Outward Proton Pump Rhodopsin into an Artificial Inward Proton Pump
MC Marín, M Konno, H Yawo, K Inoue
Journal of the American Chemical Society 145 (20), 10938-10942, 2023
22023
On excited state reaction path in reversibly switchable fluorescent proteins
D Smyrnova, MC Marín, M Olivucci, A Ceulemans
arXiv preprint arXiv:1709.06911, 2017
12017
Hydrogen-Bonding and Hydrophobic Interaction Networks as Structural Determinants of Microbial Rhodopsin Function
É Bertalan, M Konno, M del Carmen Marín, R Bagherzadeh, T Nagata, ...
The Journal of Physical Chemistry B, 2024
2024
Structural characterization of a synthetic mimic of the Photoactive Yellow Protein
G Tassone, C Pozzi, M Paolino, M Orlandini, M del Carmen Marín, ...
2019
Anabaena Sensory Rhodopsin: Effect of point mutations on PSBR photo-isomerization speed
D Agathangelou, Y Orozco-Gonzalez, MCM Pérez, J Brazard, H Kandori, ...
EPJ Web Conf. 205, 10004, 2019
2019
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