How does heparin prevent the pH inactivation of cathepsin B? Allosteric mechanism elucidated by docking and molecular dynamics

Por Costa, Mauricio GS, Batista, Paulo R, Shida, Cláudio S, Robert, Charles H, Bisch, Paulo M, Pascutti, Pedro G
Publicado em 2010

Impact of M36I polymorphism on the interaction of HIV-1 protease with its substrates: insights from molecular dynamics

Por Costa, Mauricio GS, Benetti-Barbosa, Técio G, Desdouits, Nathan, Blondel, Arnaud, Bisch, Paulo M, Pascutti, Pedro G, Batista, Paulo R
Publicado no BMC Genomics (2014)

Conformational Equilibrium of CDK/Cyclin Complexes by Molecular Dynamics with Excited Normal Modes

Por Floquet, Nicolas, Costa, Mauricio G.S., Batista, Paulo R., Renault, Pedro, Bisch, Paulo M., Raussin, Florent, Martinez, Jean, Morris, May C., Perahia, David
Publicado no Biophys J (2015)