Detalhe da pesquisa
1.
Site Identification by Ligand Competitive Saturation-Biologics Approach for Structure-Based Protein Charge Prediction.
Mol Pharm
; 20(5): 2600-2611, 2023 05 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-37017675
2.
Preserving the Integrity of Empirical Force Fields.
J Chem Inf Model
; 62(16): 3825-3831, 2022 08 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-35917398
3.
Montmorillonite clay-based sorbents decrease the bioavailability of per- and polyfluoroalkyl substances (PFAS) from soil and their translocation to plants.
Environ Res
; 205: 112433, 2022 04 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-34875259
4.
Modification of a Single Atom Affects the Physical Properties of Double Fluorinated Fmoc-Phe Derivatives.
Int J Mol Sci
; 22(17)2021 Sep 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-34502542
5.
Self-Assembled Peptide Nano-Superstructure towards Enzyme Mimicking Hydrolysis.
Angew Chem Int Ed Engl
; 60(31): 17164-17170, 2021 07 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-34014019
6.
Molecular Mechanism for Attractant Signaling to DHMA by E. coli Tsr.
Biophys J
; 118(2): 492-504, 2020 01 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-31839263
7.
Enhanced Fluorescence for Bioassembly by Environment-Switching Doping of Metal Ions.
Adv Funct Mater
; 30(10)2020 Mar 03.
Artigo
em Inglês
| MEDLINE | ID: mdl-32256278
8.
Interactions between Curcumin Derivatives and Amyloid-ß Fibrils: Insights from Molecular Dynamics Simulations.
J Chem Inf Model
; 60(1): 289-305, 2020 01 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-31809572
9.
Insights into the interactions of bisphenol and phthalate compounds with unamended and carnitine-amended montmorillonite clays.
Comput Chem Eng
; 1432020 Dec 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-33122868
10.
Isoflavones as Ah Receptor Agonists in Colon-Derived Cell Lines: Structure-Activity Relationships.
Chem Res Toxicol
; 32(11): 2353-2364, 2019 11 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-31621310
11.
A high-throughput and rapid computational method for screening of RNA post-transcriptional modifications that can be recognized by target proteins.
Methods
; 143: 34-47, 2018 07 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-29408626
12.
Elucidating the multi-targeted anti-amyloid activity and enhanced islet amyloid polypeptide binding of ß-wrapins.
Comput Chem Eng
; 116: 322-332, 2018 Aug 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-30405276
13.
Correction to "Interactions between Curcumin Derivatives and Amyloid-ß Fibrils: Insights from Molecular Dynamics Simulations".
J Chem Inf Model
; 60(8): 4108, 2020 Aug 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-32702234
14.
Sequence-based identification of amyloidogenic ß-hairpins reveals a prostatic acid phosphatase fragment promoting semen amyloid formation.
Comput Struct Biotechnol J
; 23: 417-430, 2024 Dec.
Artigo
em Inglês
| MEDLINE | ID: mdl-38223341
15.
Computational and Experimental Protocols to Study Cyclo-dihistidine Self- and Co-assembly: Minimalistic Bio-assemblies with Enhanced Fluorescence and Drug Encapsulation Properties.
Methods Mol Biol
; 2405: 179-203, 2022.
Artigo
em Inglês
| MEDLINE | ID: mdl-35298815
16.
Computational design of a ß-wrapin's N-terminal domain with canonical and non-canonical amino acid modifications mimicking curcumin's proposed inhibitory function.
Biophys Chem
; 286: 106805, 2022 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-35417810
17.
Protection of Oxygen-Sensitive Enzymes by Peptide Hydrogel.
ACS Nano
; 15(4): 6530-6539, 2021 04 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-33844499
18.
Combining Experimental Isotherms, Minimalistic Simulations, and a Model to Understand and Predict Chemical Adsorption onto Montmorillonite Clays.
ACS Omega
; 6(22): 14090-14103, 2021 Jun 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-34124432
19.
Enhanced adsorption of per- and polyfluoroalkyl substances (PFAS) by edible, nutrient-amended montmorillonite clays.
Water Res
; 188: 116534, 2021 Jan 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-33125992
20.
Hydroxylated Chalcones as Aryl Hydrocarbon Receptor Agonists: Structure-Activity Effects.
Toxicol Sci
; 180(1): 148-159, 2021 02 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-33263770