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2020 | 1 |
2022 | 2 |
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Page 1
Structure-Based Virtual Screening: From Classical to Artificial Intelligence.
Front Chem. 2020 Apr 28;8:343. doi: 10.3389/fchem.2020.00343. eCollection 2020.
Front Chem. 2020.
PMID: 32411671
Free PMC article.
Review.
Evaluation of Docking Machine Learning and Molecular Dynamics Methodologies for DNA-Ligand Systems.
de Oliveira TA, Medaglia LR, Maia EHB, Assis LC, de Carvalho PB, da Silva AM, Taranto AG.
de Oliveira TA, et al.
Pharmaceuticals (Basel). 2022 Jan 22;15(2):132. doi: 10.3390/ph15020132.
Pharmaceuticals (Basel). 2022.
PMID: 35215245
Free PMC article.
Item in Clipboard
Identification of Potential Multitarget Compounds against Alzheimer's Disease through Pharmacophore-Based Virtual Screening.
Mendes GO, Araújo Neto MF, Barbosa DB, Bomfim MRD, Andrade LSM, Carvalho PB, Oliveira TA, Falkoski DL, Maia EHB, Valle MS, Damázio LCM, Silva AMD, Taranto AG, Leite FHA.
Mendes GO, et al. Among authors: oliveira ta.
Pharmaceuticals (Basel). 2023 Nov 23;16(12):1645. doi: 10.3390/ph16121645.
Pharmaceuticals (Basel). 2023.
PMID: 38139772
Free PMC article.
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Identification of potential human beta-secretase 1 inhibitors by hierarchical virtual screening and molecular dynamics.
do Bomfim MR, Barbosa DB, de Carvalho PB, da Silva AM, de Oliveira TA, Taranto AG, Leite FHA.
do Bomfim MR, et al. Among authors: de oliveira ta.
J Biomol Struct Dyn. 2023 Jul;41(10):4560-4574. doi: 10.1080/07391102.2022.2069155. Epub 2022 May 1.
J Biomol Struct Dyn. 2023.
PMID: 35491692
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