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Shahin Sowlati-Hashjin
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The chemical bond in external electric fields: Energies, geometries, and vibrational Stark shifts of diatomic molecules
S Sowlati-Hashjin, CF Matta
The Journal of chemical physics 139 (14), 144101, 2013
982013
Synthesis and characterisation of the unsubstituted dipyrrin and 4, 4-dichloro-4-bora-3a, 4a-diaza-s-indacene: improved synthesis and functionalisation of the simplest BODIPY …
BR Groves, SM Crawford, T Lundrigan, CF Matta, S Sowlati-Hashjin, ...
Chemical Communications 49 (8), 816-818, 2013
452013
Insights into the polyhexamethylene biguanide (PHMB) mechanism of action on bacterial membrane and DNA: A molecular dynamics study
S Sowlati-Hashjin, P Carbone, M Karttunen
The Journal of Physical Chemistry B 124 (22), 4487-4497, 2020
332020
Membrane disruption by very long chain fatty acids during necroptosis
LR Parisi, S Sowlati-Hashjin, IA Berhane, SL Galster, KA Carter, JF Lovell, ...
ACS chemical biology 14 (10), 2286-2294, 2019
262019
Lewis Acid Behavior of SF4: Synthesis, Characterization, and Computational Study of Adducts of SF4 with Pyridine and Pyridine Derivatives
P Chaudhary, JT Goettel, HPA Mercier, S Sowlati‐Hashjin, P Hazendonk, ...
Chemistry–A European Journal 21 (16), 6247-6256, 2015
252015
Manipulation of Diatomic Molecules with Oriented External Electric Fields: Linear Correlations in Atomic Properties Lead to Nonlinear Molecular Responses
S Sowlati-Hashjin, M Karttunen, CF Matta
The Journal of Physical Chemistry A 124 (23), 4720-4731, 2020
182020
Computational investigation of glycosylase and β-lyase activity facilitated by proline: applications to FPG and comparisons to hOgg1
S Sowlati-Hashjin, SD Wetmore
The Journal of Physical Chemistry B 118 (50), 14566-14577, 2014
172014
Dipole Moment Surfaces of the CH4 + X → CH3 + HX (X = F, Cl) Reactions from Atomic Dipole Moment Surfaces, and the Origins of the Sharp Extrema of the …
CF Matta, S Sowlati-Hashjin, AD Bandrauk
The Journal of Physical Chemistry A 117 (32), 7468-7483, 2013
162013
Manipulation of a DNA aptamer–protein binding site through arylation of internal guanine residues
AJ Van Riesen, KL Fadock, PS Deore, A Desoky, RA Manderville, ...
Organic & Biomolecular Chemistry 16 (20), 3831-3840, 2018
142018
Quantum Mechanical Study of the β- and δ-Lyase Reactions during the Base Excision Repair Process: Application to FPG
S Sowlati-Hashjin, S Wetmore
Physical Chemistry Chemical Physics, 2015
102015
Functional oligomeric forms of uncoupling protein 2: strong evidence for asymmetry in protein and lipid bilayer systems
A Ardalan, S Sowlati-Hashjin, SO Uwumarenogie, M Fish, J Mitchell, ...
The Journal of Physical Chemistry B 125 (1), 169-183, 2020
92020
Physicochemical properties of exogenous molecules correlated with their biological efficacy as protectors against carcinogenesis and inflammation
RV Bensasson, S Sowlati-Hashjin, V Zoete, D Dauzonne, CF Matta
International Reviews in Physical Chemistry 32 (3), 393-434, 2013
82013
Biphasic proton transport mechanism for uncoupling proteins
A Ardalan, S Sowlati-Hashjin, H Oduwoye, SO Uwumarenogie, ...
The Journal of Physical Chemistry B 125 (32), 9130-9144, 2021
62021
Structural insight into the discrimination between 8-oxoguanine glycosidic conformers by DNA repair enzymes: a molecular dynamics study of human oxoguanine glycosylase 1 and …
S Sowlati-Hashjin, SD Wetmore
Biochemistry 57 (7), 1144-1154, 2018
52018
A new mixed-ligand complex of copper (II) containing N-(2-pyridylmethyl)-2-pyrazinecarboxamide (NPyPzCa): Synthesis, molecular and crystal structure and properties of [Cu …
HR Khavasi, K Sasan, SS Hashjin, M Zahedi
Comptes Rendus Chimie 14 (6), 563-567, 2011
32011
Identification of Catechins Binding Pockets in Monomeric Aβ42 Through Ensemble Docking and MD Simulations
CC Gracia, R Firouzi, S Sowlati-Hashjin, M Ashouri, MH Karimi-Jafari, ...
bioRxiv, 2022
22022
Ab initio studies of BN-acenes and cyclo BN-acenes electronic properties and their dependence on the molecular size and the number of electrons
R Firouzi, SS Hashjin, M Zahedi
Journal of Molecular Structure: THEOCHEM 905 (1-3), 1-7, 2009
22009
Collective interactions among organometallics are exotic bonds hidden on lab shelves
S Sowlati-Hashjin, V Šadek, SA Sadjadi, M Karttunen, A Martín-Pendás, ...
Nature communications 13 (1), 1-9, 2022
12022
Dawn of a New Era for Membrane Protein Design
S Sowlati-Hashjin, A Gandhi, M Garton
BioDesign Research 2022, 2022
12022
Electrostatic Fields in biophysical chemistry
S Sowlati-Hashjin, M Karttunen, CF Matta
Effects of Electric Fields on Structure and Reactivity, 225-262, 2021
12021
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