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Marta Bon
Marta Bon
Exscientia
Verified email at exscientia.co.uk
Title
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Year
Computational approaches elucidate the allosteric mechanism of human aromatase inhibition: a novel possible route to Small-molecule regulation of CYP450s activities?
J Sgrignani, M Bon, G Colombo, A Magistrato
Journal of chemical information and modeling 54 (10), 2856-2868, 2014
432014
The Structure of Sub‐nm Platinum Clusters at Elevated Temperatures
TR Henninen, M Bon, F Wang, D Passerone, R Erni
Angewandte Chemie International Edition 59 (2), 839-845, 2020
292020
Template-Assisted in Situ Synthesis of Ag@Au Bimetallic Nanostructures Employing Liquid-Phase Transmission Electron Microscopy
N Ahmad, M Bon, D Passerone, R Erni
ACS nano 13 (11), 13333-13342, 2019
262019
Characterization of vanadium species in mixed chloride–sulfate solutions: An ab initio metadynamics study
M Bon, T Laino, A Curioni, M Parrinello
The Journal of Physical Chemistry C 120 (20), 10791-10798, 2016
222016
Unraveling the interaction mechanism between amidoxime groups and vanadium ions at various pH conditions
O Nibel, M Bon, ML Agiorgousis, T Laino, L Gubler, TJ Schmidt
The Journal of Physical Chemistry C 121 (12), 6436-6445, 2017
152017
Robust, multi-length-scale, machine learning potential for Ag–Au bimetallic alloys from clusters to bulk materials
CM Andolina, M Bon, D Passerone, WA Saidi
The Journal of Physical Chemistry C 125 (31), 17438-17447, 2021
132021
Revealing the role of phosphoric acid in all-vanadium redox flow batteries with DFT calculations and in situ analysis
FJ Oldenburg, M Bon, D Perego, D Polino, T Laino, L Gubler, TJ Schmidt
Physical Chemistry Chemical Physics 20 (36), 23664-23673, 2018
132018
Atomic-resolution differential phase contrast STEM on ferroelectric materials: A mean-field approach
M Campanini, K Eimre, M Bon, CA Pignedoli, MD Rossell, R Erni
Physical Review B 101 (18), 184116, 2020
82020
Reliability of two Embedded Atom Models for the Description of Au-Ag Nanoalloys
M Bon, N Ahmad, R Erni, D Passerone
arXiv preprint arXiv:1904.10817, 2019
82019
The reaction mechanism of the azide–alkyne Huisgen cycloaddition
M Danese, M Bon, GM Piccini, D Passerone
Physical Chemistry Chemical Physics 21 (35), 19281-19287, 2019
82019
Fragment‐based drug discovery—the importance of high‐quality molecule libraries
M Bon, A Bilsland, J Bower, K McAulay
Molecular Oncology 16 (21), 3761-3777, 2022
42022
Reactivity of Covalent Fragments and Their Role in Fragment Based Drug Discovery
K McAulay, A Bilsland, M Bon
Pharmaceuticals 15 (11), 1366, 2022
2022
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Articles 1–12