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Data do documentoTítuloAutor(es)
2012Molecular modeling of the toxoplasma gondii adenosine kinase inhibitorsMancini, Daiana Teixeira; Cunha, Elaine F. F. da; Ramalho, Teodorico C.; Freitas, Matheus P.
Nov-2016Structure-based drugs design studies on spleen tyrosine kinase inhibitorsAssis, Letícia Cristina; Garcia, Letícia Santos; Mancini, Daiana Teixeira; Assis, Tamiris Maria; Silva, Daniela Rodrigues; Cardoso, Giovanna Gajo; Castro, Alexandre Alves de; Ramalho, Teodorico Castro; Cunha, Elaine Fontes Ferreira da
Ago-2010Enzymatic and structural characterization of a basic phospholipase A2 from the sea anemone Condylactis giganteaRomero, Lazara; Marcussi, Silvana; Marchi-Salvador, Daniela P.; Silva Jr., Floriano P.; Fuly, André L.; Stábeli, Rodrigo G.; Silva, Saulo L. da; González, Jorge; Del Monte, Alberto; Soares, Andreimar M.
2018The role of the oximes HI-6 and HS-6 inside human acetylcholinesterase inhibited with nerve agents: a computational studyCuya, Teobaldo; Gonçalves, Arlan da Silva; Silva, Jorge Alberto Valle da; Ramalho, Teodorico C.; Kuca, Kamil; França, Tanos C.C.
Abr-2010Host–guest complexation of a nitroheterocyclic compound with cyclodextrins: a spectrofluorimetric and molecular modeling studyGrillo, Renato; Melo, Nathalie F. S. de; Araújo, Daniele R. de; Trossini, Gustavo H. G.; Cunha, Elaine F. F. da; Ramalho, Teodorico de Castro; Fraceto, Leonardo Fernandes
4-Out-2016Towards understanding the mechanism of action of antibacterial N-alkyl-3-hydroxypyridinium salts: Biological activities, molecular modeling and QSAR studiesDolezal, Rafael; Soukup, Ondrej; Malinak, David; Savedra, Ranylson M. L.; Marek, Jan; Dolezalova, Marie; Pasdiorova, Marketa; Salajkova, Sarka; Korabecny, Jan; Honegr, Jan; Ramalho, Teodorico C.; Kuca, Kamil
2019Molecular modeling studies on the interactions of 7-methoxytacrine-4-pyridinealdoxime, 4-PA, 2-PAM, and obidoxime with VX-inhibited human acetylcholinesterase: a near attack conformation approachSilva, Jorge Alberto Valle da; Nepovimova, Eugenie; Ramalho, Teodorico Castro; Kuca, Kamil; França, Tanos Celmar Costa
Nov-20093D-QSAR CoMFA/CoMSIA models based on theoretical active conformers of HOE/BAY-793 analogs derived from HIV-1 protease inhibitor complexesCunha, Elaine Fontes Ferreira da; Sippl, Wolfgang; Ramalho, Teodoricode Castro; Antunes, Octavio Augusto Ceva; Alencastro, Ricardo Bicca de; Albuquerque, Magaly Girão
2012Application of 4D-QSAR studies to a series of raloxifene analogs and design of potential selective estrogen receptor modulatorsSodero, Ana Carolina Rennó; Romeiro, Nelilma Correia; Cunha, Elaine F. F. da; Magalhães, Uiaran de Oliveira; Alencastro, Ricardo Bicca de; Rodrigues, Carlos Rangel; Cabral, Lúcio Mendes; Castro, Helena Carla; Albuquerque, Magaly Girão
2013Interactions of pyrimidine derivatives with dihydrofolate reductase and thymidylate synthase: directions toward combating toxoplasmosisAssis, Letícia C.; Santos-Garcia, Letícia; Ramalho, Teodorico C.; Cunha, Elaine F. F. da