Insights into the substrate binding mechanism of SULT1A1 through molecular dynamics with excited normal modes simulations

por Balint Dudas, Daniel Toth, David Perahia, Arnaud B. Nicot, Erika Balog, Maria A. Miteva
Publicado 2021

In silico mechanistic profiling to probe small molecule binding to sulfotransferases.

por Virginie Y Martiny, Pablo Carbonell, David Lagorce, Bruno O Villoutreix, Gautier Moroy, Maria A Miteva
Publicado 2013

In silico model of the human ClC-Kb chloride channel: pore mapping, biostructural pathology and drug screening

por Maxime Louet, Sara Bitam, Naziha Bakouh, Yohan Bignon, Gabrielle Planelles, David Lagorce, Maria A. Miteva, Dominique Eladari, Jacques Teulon, Bruno O. Villoutreix
Publicado 2017

Computational Analysis of Chemical Space of Natural Compounds Interacting with Sulfotransferases

por Iglika Lessigiarska, Yunhui Peng, Ivanka Tsakovska, Petko Alov, Nathalie Lagarde, Dessislava Jereva, Bruno O. Villoutreix, Arnaud B. Nicot, Ilza Pajeva, Tania Pencheva, Maria A. Miteva
Publicado 2021