Binding mode prediction and MD/MMPBSA-based free energy ranking for agonists of REV-ERBα/NCoR. - Yvonne Westermaier; Sergio Ruiz-Carmona; Isabelle Theret; Françoise Perron-Sierra; Guillaume Poissonnet; Catherine Dacquet; Jean A. Boutin; Pierre Ducrot; Xavier Barril (J. Comput. Aided Mol. Des., 2017)