Yvonne Westermaier, Sergio Ruiz-Carmona, Isabelle Theret, Françoise Perron-Sierra, Guillaume Poissonnet, Catherine Dacquet, Jean A. Boutin, Pierre Ducrot, Xavier Barril. Binding mode prediction and MD/MMPBSA-based free energy ranking for agonists of REV-ERBα/NCoR. Journal of Computer-Aided Molecular Design, 31(8):755-775, 2017. [doi]
Abstract is missing.