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3-Chlorotyramine Acting as Ligand of the D<sub>2</sub> Dopamine Receptor. Molecular Modeling, Synthesis and D<sub>2</sub> Receptor Affinity.
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- Molecular Informatics, 2015, v. 34, n. 1, p. 28, doi. 10.1002/minf.201400093
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Synthesis, Bioevaluation and Structural Study of Substituted Phthalazin-1(2H)-ones Acting as Antifungal Agents.
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- Molecules, 2013, v. 18, n. 3, p. 3479, doi. 10.3390/molecules18033479
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- Article
Tetrahydroisoquinolines acting as dopaminergic ligands. A molecular modeling study using MD simulations and QM calculations.
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- Journal of Molecular Modeling, 2012, v. 18, n. 2, p. 419, doi. 10.1007/s00894-011-1061-0
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- Article
Small Peptides Derived from Penetratin as Antibacterial Agents.
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- Archiv der Pharmazie, 2016, v. 349, n. 4, p. 242, doi. 10.1002/ardp.201500419
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- Article
A New Series of Antibacterial Nitrosopyrimidines: Synthesis and Structure-Activity Relationship.
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- Archiv der Pharmazie, 2015, v. 348, n. 1, p. 68, doi. 10.1002/ardp.201400271
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- Article
Theoretical models to predict the inhibitory effect of ligands of sphingosine kinase 1 using QTAIM calculations and hydrogen bond dynamic propensity analysis.
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- Journal of Computer-Aided Molecular Design, 2018, v. 32, n. 7, p. 781, doi. 10.1007/s10822-018-0129-7
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Nonâ€covalent interactions in receptorâ€'ligand complexes. A study based on the electron charge density.
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- Journal of Physical Organic Chemistry, 2014, v. 27, n. 2, p. 128, doi. 10.1002/poc.3250
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Multistep conformational interconversion mechanism of cyclododecane. A simple and fast analysis using potential energy curves.
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- International Journal of Quantum Chemistry, 2012, v. 112, n. 11, p. 2382, doi. 10.1002/qua.23239
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Conformational and electronic study of dopamine interacting with the D<sub>2</sub> dopamine receptor.
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- Journal of Computational Chemistry, 2020, v. 41, n. 21, p. 1898, doi. 10.1002/jcc.26361
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Halogen bonding in biological context: a computational study of D2 dopamine receptor.
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- Journal of Physical Organic Chemistry, 2016, v. 29, n. 11, p. 645, doi. 10.1002/poc.3586
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Arylated analogues of cypronazole: fungicidal effect and activity on human fibroblasts. Docking analysis and molecular dynamics simulations.
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- Natural Products & Bioprospecting, 2022, v. 12, n. 1, p. 1, doi. 10.1007/s13659-022-00329-0
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- Article
Molecular design and synthesis of novel peptides from amphibians skin acting as inhibitors of cholinesterase enzymes.
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- Journal of Peptide Science, 2017, v. 23, n. 3, p. 236, doi. 10.1002/psc.2974
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Tetrahydroisoquinolines functionalized with carbamates as selective ligands of D2 dopamine receptor.
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- Journal of Molecular Modeling, 2017, v. 23, n. 9, p. 1, doi. 10.1007/s00894-017-3441-6
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- Article