Detalhe da pesquisa
1.
Kinetics of radiation-induced DNA double-strand breaks through coarse-grained simulations.
Biophys J
; 122(16): 3314-3322, 2023 08 22.
Artigo
Inglês
| MEDLINE | ID: mdl-37455429
2.
Gamma-Hemolysin Components: Computational Strategies for LukF-Hlg2 Dimer Reconstruction on a Model Membrane.
Int J Mol Sci
; 24(8)2023 Apr 12.
Artigo
Inglês
| MEDLINE | ID: mdl-37108277
3.
A Comparative Molecular Dynamics Study of Selected Point Mutations in the Shwachman-Bodian-Diamond Syndrome Protein SBDS.
Int J Mol Sci
; 23(14)2022 Jul 19.
Artigo
Inglês
| MEDLINE | ID: mdl-35887285
4.
Comparative Molecular Dynamics Investigation of the Electromotile Hearing Protein Prestin.
Int J Mol Sci
; 22(15)2021 Aug 02.
Artigo
Inglês
| MEDLINE | ID: mdl-34361083
5.
Theoretical insights on acceptor-donor dyads for organic photovoltaics.
Phys Chem Chem Phys
; 22(46): 27413-27424, 2020 Dec 07.
Artigo
Inglês
| MEDLINE | ID: mdl-33231587
6.
Effects of Membrane and Biological Target on the Structural and Allosteric Properties of Recoverin: A Computational Approach.
Int J Mol Sci
; 20(20)2019 Oct 10.
Artigo
Inglês
| MEDLINE | ID: mdl-31658639
7.
Comparative molecular dynamics study of neuromyelitis optica-immunoglobulin G binding to aquaporin-4 extracellular domains.
Biochim Biophys Acta Biomembr
; 1859(8): 1326-1334, 2017 Aug.
Artigo
Inglês
| MEDLINE | ID: mdl-28477975
8.
Challenging AQP4 druggability for NMO-IgG antibody binding using molecular dynamics and molecular interaction fields.
Biochim Biophys Acta
; 1848(7): 1462-71, 2015 Jul.
Artigo
Inglês
| MEDLINE | ID: mdl-25839357
9.
Human Aquaporin-4 and Molecular Modeling: Historical Perspective and View to the Future.
Int J Mol Sci
; 17(7)2016 Jul 13.
Artigo
Inglês
| MEDLINE | ID: mdl-27420052
10.
Identification of a point mutation impairing the binding between aquaporin-4 and neuromyelitis optica autoantibodies.
J Biol Chem
; 289(44): 30578-30589, 2014 Oct 31.
Artigo
Inglês
| MEDLINE | ID: mdl-25239624
11.
A new gating site in human aquaporin-4: Insights from molecular dynamics simulations.
Biochim Biophys Acta
; 1838(12): 3052-60, 2014 Dec.
Artigo
Inglês
| MEDLINE | ID: mdl-25150048
12.
Effects of different self-assembled monolayers on thin-film morphology: a combined DFT/MD simulation protocol.
Langmuir
; 31(39): 10693-701, 2015 Oct 06.
Artigo
Inglês
| MEDLINE | ID: mdl-26367250
13.
Morphological and charge transport properties of amorphous and crystalline P3HT and PBTTT: insights from theory.
Phys Chem Chem Phys
; 17(28): 18742-50, 2015 Jul 28.
Artigo
Inglês
| MEDLINE | ID: mdl-26118645
14.
Quality assessment and community detection methods for anonymized mobility data in the Italian Covid context.
Sci Rep
; 14(1): 4636, 2024 02 26.
Artigo
Inglês
| MEDLINE | ID: mdl-38409411
15.
A conformational rearrangement of the SARS-CoV-2 host protein sigma-1 is required for antiviral activity: insights from a combined in-silico/in-vitro approach.
Sci Rep
; 13(1): 12798, 2023 08 07.
Artigo
Inglês
| MEDLINE | ID: mdl-37550340
16.
Membrane binding of pore-forming γ-hemolysin components studied at different lipid compositions.
Biochim Biophys Acta Biomembr
; 1864(9): 183970, 2022 09 01.
Artigo
Inglês
| MEDLINE | ID: mdl-35605647
17.
Mechanism of action of cyclophilin a explored by metadynamics simulations.
PLoS Comput Biol
; 5(3): e1000309, 2009 Mar.
Artigo
Inglês
| MEDLINE | ID: mdl-19282959
18.
G protein inactive and active forms investigated by simulation methods.
Proteins
; 75(4): 919-30, 2009 Jun.
Artigo
Inglês
| MEDLINE | ID: mdl-19089952
19.
Three-dimensional microtubule behavior in Xenopus egg extracts reveals four dynamic states and state-dependent elastic properties.
Biophys J
; 95(3): 1474-86, 2008 Aug.
Artigo
Inglês
| MEDLINE | ID: mdl-18441022
20.
Conformations of confined biopolymers.
Phys Rev E Stat Nonlin Soft Matter Phys
; 75(5 Pt 1): 050902, 2007 May.
Artigo
Inglês
| MEDLINE | ID: mdl-17677015