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1.
First Report on Yield and Chemical Composition of Essential Oil Extracted from Myrcia eximia DC (Myrtaceae) from the Brazilian Amazon.
Molecules
; 25(4)2020 Feb 12.
Artículo
en Inglés
| MEDLINE | ID: mdl-32059439
2.
Chemical Composition, Antimicrobial Properties of Siparuna guianensis Essential Oil and a Molecular Docking and Dynamics Molecular Study of its Major Chemical Constituent.
Molecules
; 25(17)2020 Aug 25.
Artículo
en Inglés
| MEDLINE | ID: mdl-32854178
3.
Pharmacophore-based virtual screening and molecular docking to identify promising dual inhibitors of human acetylcholinesterase and butyrylcholinesterase.
J Biomol Struct Dyn
; 39(16): 6021-6030, 2021 10.
Artículo
en Inglés
| MEDLINE | ID: mdl-32705955
4.
Density functional theory for the thermodynamic gas-phase investigation of butanol biofuel and its isomers mixed with gasoline and ethanol.
J Mol Model
; 27(3): 80, 2021 Feb 11.
Artículo
en Inglés
| MEDLINE | ID: mdl-33575832
5.
Potential inhibitors of the enzyme acetylcholinesterase and juvenile hormone with insecticidal activity: study of the binding mode via docking and molecular dynamics simulations.
J Biomol Struct Dyn
; 38(16): 4687-4709, 2020 Oct.
Artículo
en Inglés
| MEDLINE | ID: mdl-31674282
6.
Chemical profile of Lippia thymoides, evaluation of the acetylcholinesterase inhibitory activity of its essential oil, and molecular docking and molecular dynamics simulations.
PLoS One
; 14(3): e0213393, 2019.
Artículo
en Inglés
| MEDLINE | ID: mdl-30849129
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