フォロー
Samer Gozem
タイトル
引用先
引用先
Theory and Simulation of the Ultrafast Double-Bond Isomerization of Biological Chromophores
S Gozem, HL Luk, I Schapiro, M Olivucci
Chemical Reviews 117 (22), 13502–13565, 2017
2562017
Shape of multireference, equation-of-motion coupled-cluster, and density functional theory potential energy surfaces at a conical intersection
S Gozem, F Melaccio, A Valentini, M Filatov, M Huix-Rotllant, N Ferre, ...
Journal of chemical theory and computation 10 (8), 3074-3084, 2014
1912014
Dynamic electron correlation effects on the ground state potential energy surface of a retinal chromophore model
S Gozem, M Huntress, I Schapiro, R Lindh, AA Granovsky, C Angeli, ...
Journal of chemical theory and computation 8 (11), 4069-4080, 2012
1582012
Assessment of approximate coupled-cluster and algebraic-diagrammatic-construction methods for ground-and excited-state reaction paths and the conical-intersection seam of a …
D Tuna, D Lefrancois, Ł Wolański, S Gozem, I Schapiro, T Andruniów, ...
Journal of Chemical Theory and Computation 11 (12), 5758-5781, 2015
1412015
Photoelectron wave function in photoionization: Plane wave or Coulomb wave?
S Gozem, AO Gunina, T Ichino, DL Osborn, JF Stanton, AI Krylov
The journal of physical chemistry letters 6 (22), 4532-4540, 2015
1402015
The molecular mechanism of thermal noise in rod photoreceptors
S Gozem, I Schapiro, N Ferré, M Olivucci
Science 337 (6099), 1225-1228, 2012
1182012
A study of interstellar aldehydes and enols as tracers of a cosmic ray-driven nonequilibrium synthesis of complex organic molecules
MJ Abplanalp, S Gozem, AI Krylov, CN Shingledecker, E Herbst, RI Kaiser
Proceedings of the National Academy of Sciences 113 (28), 7727-7732, 2016
1152016
Assessment of Density Functional Theory for Describing the Correlation Effects on the Ground and Excited State Potential Energy Surfaces of a Retinal Chromophore Model
M Huix-Rotllant, M Filatov, S Gozem, I Schapiro, M Olivucci, N Ferré
Journal of Chemical Theory and Computation 9 (9), 3917–3932, 2013
1042013
Mapping the excited state potential energy surface of a retinal chromophore model with multireference and equation-of-motion coupled-cluster methods
S Gozem, F Melaccio, R Lindh, AI Krylov, AA Granovsky, C Angeli, ...
Journal of Chemical Theory and Computation 9 (10), 4495-4506, 2013
942013
Supramolecular sensors for opiates and their metabolites
EG Shcherbakova, B Zhang, S Gozem, T Minami, PY Zavalij, M Pushina, ...
Journal of the American Chemical Society 139 (42), 14954-14960, 2017
932017
The ezSpectra suite: An easy‐to‐use toolkit for spectroscopy modeling
S Gozem, AI Krylov
Wiley Interdisciplinary Reviews: Computational Molecular Science 12 (2), e1546, 2022
882022
Conical intersection and potential energy surface features of a model retinal chromophore: Comparison of EOM-CC and multireference methods
S Gozem, AI Krylov, M Olivucci
Journal of chemical theory and computation 9 (1), 284-292, 2013
812013
Comparison of the isomerization mechanisms of human melanopsin and invertebrate and vertebrate rhodopsins
S Rinaldi, F Melaccio, S Gozem, F Fanelli, M Olivucci
Proceedings of the National Academy of Sciences 111 (5), 1714-1719, 2014
672014
Combined Self-Consistent-Field and Spin-Flip Tamm–Dancoff Density Functional Approach to Potential Energy Surfaces for Photochemistry
X Xu, S Gozem, M Olivucci, DG Truhlar
The Journal of Physical Chemistry Letters 4 (2), 253-258, 2012
562012
Probing the photodynamics of rhodopsins with reduced retinal chromophores
M Manathunga, X Yang, HL Luk, S Gozem, LM Frutos, A Valentini, ...
Journal of Chemical Theory and Computation 12 (2), 839-850, 2016
512016
Molecular bases for the selection of the chromophore of animal rhodopsins
HL Luk, F Melaccio, S Rinaldi, S Gozem, M Olivucci
Proceedings of the National Academy of Sciences 112 (50), 15297-15302, 2015
512015
Quantum monte carlo treatment of the charge transfer and diradical electronic character in a retinal chromophore minimal model
A Zen, E Coccia, S Gozem, M Olivucci, L Guidoni
Journal of Chemical Theory and Computation 11 (3), 992-1005, 2015
472015
Learning from photobiology how to design molecular devices using a computer
S Gozem, F Melaccio, HL Luk, S Rinaldi, M Olivucci
Chemical Society Reviews 43 (12), 4019-4036, 2014
452014
Towards an Understanding of the Retinal Chromophore in Rhodopsin Mimics
MM Huntress, S Gozem, KR Malley, AE Jailaubekov, C Vasileiou, ...
The Journal of Physical Chemistry B 117 (35), 10053–10070, 2013
442013
Electronic spectra of flavin in different redox and protonation states: a computational perspective on the effect of the electrostatic environment
MP Kabir, Y Orozco-Gonzalez, S Gozem
Physical Chemistry Chemical Physics 21 (30), 16526-16537, 2019
382019
現在システムで処理を実行できません。しばらくしてからもう一度お試しください。
論文 1–20