Pinto, Gaspar P.
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Q-RepEx: A Python pipeline to increase the sampling of empi..:

Brickel, Sebastian ; Demkiv, Andrey O. ; Crean, Rory M...
Journal of Molecular Graphics and Modelling.  119 (2023)  - p. 108402 , 2023
 
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Screening of world approved drugs against highly dynamical ..:

Pinto, Gaspar P. ; Vavra, Ondrej ; Marques, Sergio M....
Computational and Structural Biotechnology Journal.  19 (2021)  - p. 3187-3197 , 2021
 
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The impact of tunnel mutations on enzymatic catalysis depen..:

Kokkonen, Piia ; Slanska, Michaela ; Dockalova, Veronika...
Computational and Structural Biotechnology Journal.  18 (2020)  - p. 805-813 , 2020
 
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