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A unique peptide-based pharmacophore identifies an inhibitory compound against the A-subunit of Shiga toxin.
- Published in:
- Scientific Reports, 2022, v. 12, n. 1, p. 1, doi. 10.1038/s41598-022-15316-1
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- Article
Inverse Mixed-Solvent Molecular Dynamics for Visualization of the Residue Interaction Profile of Molecular Probes.
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- International Journal of Molecular Sciences, 2022, v. 23, n. 9, p. 4749, doi. 10.3390/ijms23094749
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- Article
The transcriptional corepressor CtBP2 serves as a metabolite sensor orchestrating hepatic glucose and lipid homeostasis.
- Published in:
- Nature Communications, 2021, v. 12, n. 1, p. 1, doi. 10.1038/s41467-021-26638-5
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- Article
Molecular action of larvicidal flavonoids on ecdysteroidogenic glutathione S-transferase Noppera-bo in Aedes aegypti.
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- BMC Biology, 2022, v. 20, n. 1, p. 1, doi. 10.1186/s12915-022-01233-2
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- Article
Identification of potential inhibitors based on compound proposal contest: Tyrosine-protein kinase Yes as a target.
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- Scientific Reports, 2015, p. 17209, doi. 10.1038/srep17209
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- Article
Pharmacophore Modeling for Anti-Chagas Drug Design Using the Fragment Molecular Orbital Method.
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- PLoS ONE, 2015, v. 10, n. 5, p. 1, doi. 10.1371/journal.pone.0125829
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- Article
A prospective compound screening contest identified broader inhibitors for Sirtuin 1.
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- Scientific Reports, 2019, v. 9, n. 1, p. 1, doi. 10.1038/s41598-019-55069-y
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- Article
Molecular Dynamics Simulation reveals the mechanism by which the Influenza Cap-dependent Endonuclease acquires resistance against Baloxavir marboxil.
- Published in:
- Scientific Reports, 2019, v. 9, n. 1, p. N.PAG, doi. 10.1038/s41598-019-53945-1
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- Article
Non-steroidal inhibitors of Drosophila melanogaster steroidogenic glutathione S-transferase Noppera-bo.
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- Journal of Pesticide Science, 2021, v. 46, n. 1, p. 75, doi. 10.1584/jpestics.D20-072
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- Article
Identification of key interactions between SARS-CoV-2 main protease and inhibitor drug candidates.
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- Scientific Reports, 2020, v. 10, n. 1, p. 1, doi. 10.1038/s41598-020-69337-9
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- Article
Compound property enhancement by virtual compound synthesis.
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- Journal of Bioinformatics & Computational Biology, 2018, v. 16, n. 3, p. N.PAG, doi. 10.1142/S0219720018400164
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- Article
Temperature–pressure shuffling outlier flooding method enhances the conformational sampling of proteins.
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- Journal of Computational Chemistry, 2019, v. 40, n. 15, p. 1530, doi. 10.1002/jcc.25806
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- Article