Browsing by Author França, Tanos C. C.

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Issue DateTitleAuthor(s)
Nov-2011Analysis of Bacillus anthracis nucleoside hydrolase via in silico docking with inhibitors and molecular dynamics simulationGuimarães, Ana P.; Oliveira, Aline A.; Cunha, Elaine F. F. da; Ramalho, Teodorico C.; França, Tanos C. C.
2015Bubonic plague: historical aspects and therapyCortopassi, Wilian A.; Ramalho, Teodorico C.; Fraga, Carlos A. M.; Mangas, Iris; Kuča, Kamil; França, Tanos C. C.
2014Chemical warfare: perspectives on reactivating the enzyme acetylcholinesterase inhibited by organophosphatesGiacoppo, Juliana de O. S.; Lima, Willian E. A. de; Kuča, Kamil; Cunha, Elaine F. F. da; França, Tanos C. C.; Ramalho, Teodorico de C.
2016Clinical aspects of the poisoning by the pesticide endosulfanPatočka, Jiří; Wu, Qinghua; França, Tanos C. C.; Ramalho, Teodorico C.; Pita, Rene; Kuča, Kamil
2016Current approaches against Alzheimer's disease in clinical trialsKuca, Kamil; Soukup, Ondrej; Maresova, Petra; Korabecny, Jan; Nepovimova, Eugenie; Klimova, Blanka; Honegr, Jan; Ramalho, Teodorico C.; França, Tanos C. C.
Feb-2015Design of inhibitors of thymidylate kinase from Variola virus as new selective drugs against smallpoxGuimarães, Ana P.; Souza, Felipe R. de; Oliveira, Aline A.; Gonçalves, Arlan S.; Alencastro, Ricardo B. de; Ramalho, Teodorico C.; França, Tanos C. C.
2011Design of new chemotherapeutics against the deadly anthrax disease. Docking and molecular dynamics studies of inhibitors containing pyrrolidine and riboamidrazone rings on nucleoside hydrolase from Bacillus anthracisaining Pyrrolidine and Riboamidrazone Rings on Nucleoside Hydrolase from Bacillus anthracisGuimarães, Ana P.; Oliveira, Aline A.; Cunha, Elaine F. F. da; Ramalho, Teodorico C.; França, Tanos C. C.
2016Docking and molecular dynamics studies of peripheral site ligand–oximes as reactivators of sarin-inhibited human acetylcholinesteraseAlmeida, Joyce S. F. D. de; Guizado, Teobaldo R. Cuya; Guimarães, Ana P.; Ramalho, Teodorico C.; Gonçalves, Arlan S.; Koning, Martijn C. de; França, Tanos C. C.
2019Esterase 2 as a fluorescent biosensor for the detection of organophosphorus compounds: docking and electronic insights from molecular dynamicsPrandi, Ingrid G.; Ramalho, Teodorico C.; França, Tanos C. C.
2012First principles calculations of thermodynamics and kinetic parameters and molecular dynamics simulations of acetylcholinesterase reactivators: can mouse data provide new insights into humans?Matos, Karina S.; Cunha, Elaine F. F. da; Gonçalves, Arlan da Silva; Wilter, Alan; Kuča, Kamil; França, Tanos C. C.; Ramalho, Teodorico C.
2017Mechanistic studies of new oximes reactivators of human butyryl cholinesterase inhibited by cyclosarin and sarinLima, Willian E. Amaral de; Francisco, Ander; Cunha, Elaine Fontes Ferreira da; Radic, Zoran; Taylor, Palmer; França, Tanos C. C.; Ramalho, Teodorico C.
Oct-2011Molecular aspects of the reactivation process of acetylcholinesterase inhibited by cyclosarinMatos, Karina S.; Mancini, Daiana T.; Cunha, Elaine F. F. da; Kuča, Kamil; França, Tanos C. C.; Ramalho, Teodorico C.
2015Molecular modeling and in vitro reactivation study between the oxime BI-6 and acetylcholinesterase inhibited by different nerve agentsGiacoppo, Juliana O. S.; França, Tanos C. C.; Kuča, Kamil; Cunha, Elaine F. F. da; Abagyan, Ruben; Mancini, Daiana Teixeira; Ramalho, Teodorico C.
2013Molecular modeling studies of piperidine derivatives as new acetylcholinesterase inhibitors against neurodegenerative diseasesCunha, Elaine F. F. da; Resende, José E.; França, Tanos C. C.; Gonçalves, Mateus Aquino; Souza, Felipe R. de; Santos-Garcia, Letícia; Ramalho, Teodorico C.
2011Molecular modeling studies of Yersinia pestis dihydrofolate reductaseOliveira, Aline A.; Rennó, Magdalena N.; Matos, César A. S. de; Bertuzzi, Morena D.; Ramalho, Teodorico C.; Fraga, Carlos A.M.; França, Tanos C. C.
2012Molecular modeling studies on nucleoside hydrolase from the biological warfare agent Brucella suisMancini, Daiana Teixeira; Matos, Karina S.; Cunha, Elaine F. F. da; Assis, Tamiris M.; Guimarães, Ana P.; França, Tanos C. C.; Ramalho, Teodorico C.
16-Feb-2015Molecular modeling toward selective inhibitors of dihydrofolate reductase from the biological warfare agent Bacillus anthracisGiacoppo, Juliana O. S.; Mancini, Daiana T.; Guimarães, Ana P.; Gonçalves, Arlan S.; Cunha, Elaine F. F. da; França, Tanos C. C.; Ramalho, Teodorico C.
2020Oxime K074: in vitro and in silico reactivation of acetylcholinesterase inhibited by nerve agents and pesticidesKuca, Kamil; Musilek, Kamil; Jun, Daniel; Nepovimova, Eugenie; Soukup, Ondrej; Korabecny, Jan; França, Tanos C. C.; Castro, Alexandre A. de; Krejcar, Ondrej; Cunha, Elaine F. F. da; Ramalho, Teodorico C.
Oct-2015Parallel flexible molecular docking in computational chemistry on high performance computing clustersDoleza, Rafael; Ramalho, Teodorico C.; França, Tanos C. C.; Kuca, Kamil
Aug-2019Slight difference in the isomeric oximes K206 and K203 makes huge difference for the reactivation of organophosphorus-inhibited AChE: theoretical and experimental aspectsPolisel, Daniel A.; Castro, Alexandre A. de; Mancini, Daiana T.; Cunha, Elaine F. F. da; França, Tanos C. C.; Ramalho, Teodorico C.; Kuca, Kamil