Detalhe da pesquisa
1.
Structure of the Inhibited State of the Sec Translocon.
Mol Cell
; 79(3): 406-415.e7, 2020 08 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-32692975
2.
Structural basis of antifolate recognition and transport by PCFT.
Nature
; 595(7865): 130-134, 2021 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-34040256
3.
Recovery from desensitization in GluA2 AMPA receptors is affected by a single mutation in the N-terminal domain interface.
J Biol Chem
; 300(3): 105717, 2024 Mar.
Artigo
em Inglês
| MEDLINE | ID: mdl-38311178
4.
Computed Protein-Protein Enthalpy Signatures as a Tool for Identifying Conformation Sampling Problems.
J Chem Inf Model
; 63(19): 6095-6108, 2023 10 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-37759363
5.
Limitations of non-polarizable force fields in describing anion binding poses in non-polar synthetic hosts.
Phys Chem Chem Phys
; 25(26): 17596-17608, 2023 Jul 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-37365974
6.
Correction: Limitations of non-polarizable force fields in describing anion binding poses in non-polar synthetic hosts.
Phys Chem Chem Phys
; 25(29): 20145, 2023 Jul 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-37455541
7.
State-dependent protein-lipid interactions of a pentameric ligand-gated ion channel in a neuronal membrane.
PLoS Comput Biol
; 17(2): e1007856, 2021 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-33571182
8.
SAMPL7 protein-ligand challenge: A community-wide evaluation of computational methods against fragment screening and pose-prediction.
J Comput Aided Mol Des
; 36(4): 291-311, 2022 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-35426591
9.
Muscle acetylcholine receptor conversion into chloride conductance at positive potentials by a single mutation.
Proc Natl Acad Sci U S A
; 116(42): 21228-21235, 2019 10 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-31570625
10.
Identification of compounds that bind the centriolar protein SAS-6 and inhibit its oligomerization.
J Biol Chem
; 295(52): 17922-17934, 2020 12 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-32873708
11.
Substrate conformational dynamics facilitate structure-specific recognition of gapped DNA by DNA polymerase.
Nucleic Acids Res
; 47(20): 10788-10800, 2019 11 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-31544938
12.
Proton Control of Transitions in an Amino Acid Transporter.
Biophys J
; 117(7): 1342-1351, 2019 10 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-31500802
13.
Mutational Analysis and Modeling of Negative Allosteric Modulator Binding Sites in AMPA Receptors.
Mol Pharmacol
; 96(6): 835-850, 2019 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-31582576
14.
Towards understanding promiscuity in multidrug efflux pumps.
Trends Biochem Sci
; 39(1): 8-16, 2014 Jan.
Artigo
em Inglês
| MEDLINE | ID: mdl-24316304
15.
Role of the Cys Loop and Transmembrane Domain in the Allosteric Modulation of α4ß2 Nicotinic Acetylcholine Receptors.
J Biol Chem
; 292(2): 551-562, 2017 Jan 13.
Artigo
em Inglês
| MEDLINE | ID: mdl-27864368
16.
The Startle Disease Mutation E103K Impairs Activation of Human Homomeric α1 Glycine Receptors by Disrupting an Intersubunit Salt Bridge across the Agonist Binding Site.
J Biol Chem
; 292(12): 5031-5042, 2017 03 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-28174298
17.
BET bromodomain ligands: Probing the WPF shelf to improve BRD4 bromodomain affinity and metabolic stability.
Bioorg Med Chem
; 26(11): 2937-2957, 2018 07 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-29776834
18.
Functional Validation of Heteromeric Kainate Receptor Models.
Biophys J
; 113(10): 2173-2177, 2017 Nov 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-28935133
19.
Predictions of Ligand Selectivity from Absolute Binding Free Energy Calculations.
J Am Chem Soc
; 139(2): 946-957, 2017 01 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-28009512
20.
Statistical Analysis on the Performance of Molecular Mechanics Poisson-Boltzmann Surface Area versus Absolute Binding Free Energy Calculations: Bromodomains as a Case Study.
J Chem Inf Model
; 57(9): 2203-2221, 2017 09 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-28786670