Ana L. M. Karl

Highly Flexible Ligand Docking: Benchmarking of the DockThor Program on the LEADS-PEP Protein–Peptide Data Set

Karina B. Santos, Isabella Alvim Guedes, Ana L. M. Karl et al. · Journal of Chemical Information and Modeling · 2020 · 271 citations

Pharmacy, Bioinformatics, Medicinal Chemistry +17

Drug design and repurposing with DockThor-VS web server focusing on SARS-CoV-2 therapeutic targets and their non-synonym variants

Isabella Alvim Guedes, Leon S. C. Costa, Karina B. Santos et al. · Scientific Reports · 2021 · 156 citations · Full text

Pharmacy, Bioinformatics, Molecular Biology +16

Novel series of tacrine-tianeptine hybrids: Synthesis, cholinesterase inhibitory activity, S100B secretion and a molecular modeling approach

Marco Antônio Ceschi, Jessie Sobieski da Costa, João Paulo Bizarro Lopes et al. · European Journal of Medicinal Chemistry · 2016 · 45 citations · Full text

Life Sciences, Medicinal Chemistry, Pharmacology +17

Chiral Bistacrine Analogues: Synthesis, Cholinesterase Inhibitory Activity and a Molecular Modeling Approach

João Paulo Bizarro Lopes, Jessie Sobieski da Costa, Marco Antônio Ceschi et al. · Journal of the Brazilian Chemical Society · 2017 · 15 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +14