Nitriles: an attractive approach to the development of covalent inhibitors von Bonatto, Vinícius, Lameiro, Rafael F, Rocho, Fernanda R, Lameira, Jerônimo, Leitão, Andrei, Montanari, Carlos A

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Differential specificity of SARS-CoV-2 main protease variants on peptide versus protein-based substrates von Rocho, Fernanda R, Snipas, Scott J, Shamim, Anwar, Rut, Wioletta, Drag, Marcin, Montanari, Carlos A, Salvesen, Guy S

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Nitrile-based peptoids as cysteine protease inhibitors von Alves, Luana, Santos, Deborah A., Cendron, Rodrigo, Rocho, Fernanda R., Matos, Thiago K.B., Leitão, Andrei, Montanari, Carlos A.

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Predicting the Relative Binding Affinity for Reversible Covalent Inhibitors by Free Energy Perturbation Calculations von Bonatto, Vinícius, Shamim, Anwar, Rocho, Fernanda dos R, Leitão, Andrei, Luque, F. Javier, Lameira, Jerônimo, Montanari, Carlos A

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Crystal structure of Leishmania mexicana cysteine protease B in complex with a high-affinity azadipeptide nitrile inhibitor von Ribeiro, Jean F.R., Cianni, Lorenzo, Li, Chan, Warwick, Thomas G., de Vita, Daniela, Rosini, Fabiana, dos Reis Rocho, Fernanda, Martins, Felipe C.P., Kenny, Peter W., Lameira, Jeronimo, Leitão, Andrei, Emsley, Jonas, Montanari, Carlos A.

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Mapping the S1 and S1' subsites of cysteine proteases with new dipeptidyl nitrile inhibitors as trypanocidal agents von Cianni, Lorenzo, Lemke, Carina, Gilberg, Erik, Feldmann, Christian, Rosini, Fabiana, Rocho, Fernanda Dos Reis, Ribeiro, Jean F R, Tezuka, Daiane Y, Lopes, Carla D, de Albuquerque, Sérgio, Bajorath, Jürgen, Laufer, Stefan, Leitão, Andrei, Gütschow, Michael, Montanari, Carlos A

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Optimization strategy of single-digit nanomolar cross-class inhibitors of mammalian and protozoa cysteine proteases von Cianni, Lorenzo, Rocho, Fernanda dos Reis, Rosini, Fabiana, Bonatto, Vinícius, Ribeiro, Jean F.R., Lameira, Jerônimo, Leitão, Andrei, Shamim, Anwar, Montanari, Carlos A.

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