Detalhe da pesquisa
1.
Martini 3: a general purpose force field for coarse-grained molecular dynamics.
Nat Methods
; 18(4): 382-388, 2021 04.
Artigo
Inglês
| MEDLINE | ID: mdl-33782607
2.
Inverse Conformational Selection in Lipid-Protein Binding.
J Am Chem Soc
; 143(34): 13701-13709, 2021 09 01.
Artigo
Inglês
| MEDLINE | ID: mdl-34465095
3.
Asymmetric CorA Gating Mechanism as Observed by Molecular Dynamics Simulations.
J Chem Inf Model
; 61(5): 2407-2417, 2021 05 24.
Artigo
Inglês
| MEDLINE | ID: mdl-33886304
4.
Molecular electrometer and binding of cations to phospholipid bilayers.
Phys Chem Chem Phys
; 18(47): 32560-32569, 2016 Nov 30.
Artigo
Inglês
| MEDLINE | ID: mdl-27874109
5.
Lateral membrane organization as target of an antimicrobial peptidomimetic compound.
Nat Commun
; 14(1): 4038, 2023 07 07.
Artigo
Inglês
| MEDLINE | ID: mdl-37419980
6.
Membrane manipulation by free fatty acids improves microbial plant polyphenol synthesis.
Nat Commun
; 14(1): 5619, 2023 09 12.
Artigo
Inglês
| MEDLINE | ID: mdl-37699874
7.
Membrane thickness, lipid phase and sterol type are determining factors in the permeability of membranes to small solutes.
Nat Commun
; 13(1): 1605, 2022 03 25.
Artigo
Inglês
| MEDLINE | ID: mdl-35338137
8.
Quantitative linear dichroism imaging of molecular processes in living cells made simple by open software tools.
Commun Biol
; 4(1): 189, 2021 02 12.
Artigo
Inglês
| MEDLINE | ID: mdl-33580182
9.
Adaptive response to wine selective pressures shapes the genome of a Saccharomyces interspecies hybrid.
Microb Genom
; 7(8)2021 08.
Artigo
Inglês
| MEDLINE | ID: mdl-34448691
10.
Improved Cation Binding to Lipid Bilayers with Negatively Charged POPS by Effective Inclusion of Electronic Polarization.
J Chem Theory Comput
; 16(1): 738-748, 2020 Jan 14.
Artigo
Inglês
| MEDLINE | ID: mdl-31762275
11.
Dual Resolution Membrane Simulations Using Virtual Sites.
J Phys Chem B
; 124(19): 3944-3953, 2020 05 14.
Artigo
Inglês
| MEDLINE | ID: mdl-32314586
12.
Accurate Biomolecular Simulations Account for Electronic Polarization.
Front Mol Biosci
; 6: 143, 2019.
Artigo
Inglês
| MEDLINE | ID: mdl-31867342
13.
Headgroup Structure and Cation Binding in Phosphatidylserine Lipid Bilayers.
J Phys Chem B
; 123(43): 9066-9079, 2019 10 31.
Artigo
Inglês
| MEDLINE | ID: mdl-31574222
14.
Accurate Binding of Sodium and Calcium to a POPC Bilayer by Effective Inclusion of Electronic Polarization.
J Phys Chem B
; 122(16): 4546-4557, 2018 04 26.
Artigo
Inglês
| MEDLINE | ID: mdl-29608850
15.
Transmembrane Potential Modeling: Comparison between Methods of Constant Electric Field and Ion Imbalance.
J Chem Theory Comput
; 12(5): 2418-25, 2016 May 10.
Artigo
Inglês
| MEDLINE | ID: mdl-27014925
16.
Estimation of Transition-Metal Empirical Parameters for Molecular Mechanical Force Fields.
J Chem Theory Comput
; 12(8): 3681-8, 2016 Aug 09.
Artigo
Inglês
| MEDLINE | ID: mdl-27337427