Articles with public access mandates - Samira GholamiLearn more
Not available anywhere: 1
Double Centrosymmetric Si··· π Tetrel Bonds as New Synthons─ Evidence from Crystal Structures and DFT Calculations
M Aarabi, S Gholami, SJ Grabowski
The Journal of Physical Chemistry A 127 (47), 9995-10007, 2023
Mandates: Government of Spain
Available somewhere: 8
Multistate multiconfiguration quantum chemical computation of the two-photon absorption spectra of bovine rhodopsin
S Gholami, L Pedraza-González, X Yang, AA Granovsky, IN Ioffe, ...
The journal of physical chemistry letters 10 (20), 6293-6300, 2019
Mandates: US National Science Foundation, US National Institutes of Health
Theoretical model of the protochlorophyllide oxidoreductase from a hierarchy of protocols
S Gholami, A Nenov, I Rivalta, M Bocola, AK Bordbar, U Schwaneberg, ...
The Journal of Physical Chemistry B 122 (31), 7668-7681, 2018
Mandates: German Research Foundation
Coexistence of intra-and intermolecular hydrogen bonds: salicylic acid and salicylamide and their thiol counterparts
S Gholami, M Aarabi, SJ Grabowski
The Journal of Physical Chemistry A 125 (7), 1526-1539, 2021
Mandates: Government of Spain
S− H… O and O− H… O Hydrogen Bonds‐Comparison of Dimers of Thiocarboxylic and Carboxylic Acids
M Aarabi, S Gholami, SJ Grabowski
ChemPhysChem 21 (15), 1653-1664, 2020
Mandates: Government of Spain
Hydrogen and Lithium Bonds—Lewis Acid Units Possessing Multi-Center Covalent Bonds
M Aarabi, S Gholami, SJ Grabowski
Molecules 26 (22), 6939, 2021
Mandates: Government of Spain
Ternary complex formation and photoactivation of a photoenzyme results in altered protein dynamics
AM Stadler, J Schneidewind, M Zamponi, E Knieps-Grünhagen, ...
The Journal of Physical Chemistry B 123 (34), 7372-7384, 2019
Mandates: German Research Foundation
Quantum-Classical Protocol for Efficient Characterization of Absorption Lineshape and Fluorescence Quenching upon Aggregation: The Case of Zinc Phthalocyanine Dyes
M Aarabi, D Aranda, S Gholami, SK Meena, F Lerouge, Y Bretonniere, ...
Journal of Chemical Theory and Computation 19 (17), 5938-5957, 2023
Mandates: Department of Science & Technology, India, European Commission, Agence …
Proton and Lithium Cations Linked to π‐Electron and σ‐Electron Systems: Are Such Interactions beyond or within the Definition of Hydrogen/Lithium Bond?
S Gholami, M Aarabi, SJ Grabowski
ChemPhysChem 23 (20), e202200273, 2022
Mandates: Government of Spain
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