In silico evaluation of N-aryl-1,10-phenanthroline-2-amines as potential inhibitors of T. cruzi GP63 zinc-metalloprotease by docking and molecular dynamics simulations by Priscila Goes Camargo, Ramon Borges da Silva, Aline Araujo Zuma, Simon J. Garden, Magaly Girão Albuquerque, Carlos Rangel Rodrigues, Camilo Henrique da Silva Lima

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XGBMUT: Predicting the Functional Impact of Missense Mutations Using an Extreme Gradient Boost Classifier by Gabriel Rodrigues Coutinho Pereira, Loiane Mendonça Abrantes Da Conceição, Bárbara de Azevedo Abrahim-Vieira, Carlos Rangel Rodrigues, Lucio Mendes Cabral, Ricardo Limongi França Coelho, Joelma Freire De Mesquita

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In vitro assays identified thiohydantoins with anti-trypanosomatid activity and molecular modelling studies indicated possible selective CYP51 inhibition by Priscila Goes Camargo, Helena Tiemi Suzukawa, Patrícia Morais Lopes Pereira, Mariana Luiza Silva, Fernando Macedo Jr, Magaly Girão Albuquerque, Carlos Rangel Rodrigues, Sueli Fumie Yamada-Ogatta, Camilo Henrique da Silva Lima, Marcelle de Lima Ferreira Bispo

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Molluscicidal and Schistosomicidal Activities of 2-(1<i>H</i>-Pyrazol-1-<i>yl</i>)-1,3,4-thiadiazole Derivatives by Leonardo da Silva Rangel, Daniel Tadeu Gomes Gonzaga, Ana Cláudia Rodrigues da Silva, Natalia Lindmar von Ranke, Carlos Rangel Rodrigues, José Augusto Albuquerque dos Santos, Nubia Boechat, Keyla Nunes Farias Gomes, Guilherme Pegas Teixeira, Robson Xavier Faria

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Statine-based peptidomimetics as SARS-CoV-2 Papain-like protease inhibitors: in Silico and in vitro studies by Raiane Dandara Pereira Pimentel, Priscila Goes Camargo, Pedro Henrique R. de A. Azevedo, Larissa Esteves Carvalho Constant, Stephany da Silva Costa, Diego Allonso, Carlos Rangel Rodrigues, Magaly Girão Albuquerque, Luiza R. S. Dias, Estela Maris F. Muri, Camilo Henrique da Silva Lima

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Synthesis and Structure–Activity Relationship of Thiourea Derivatives Against <i>Leishmania amazonensis</i> by Gil Mendes Viana, Edézio Ferreira da Cunha-Junior, Paloma Wetler Meireles Carreiros Assumpção, Marianne Grilo Rezende, Yago Sousa dos Santos Emiliano, Laiza Maria da Silva Soares, Gabriel Rodrigues Coutinho Pereira, Carlos Rangel Rodrigues, Lucio Mendes Cabral, Eduardo Caio Torres-Santos

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