Discovery of Novel GR Ligands toward Druggable GR Antagonist Conformations Identified by MD Simulations and Markov State Model Analysis.

Hu X, Pang J, Zhang J, Shen C, Chai X, Wang E, Chen H, Wang X, Duan M, Fu W, Xu L, Kang Y, Li D, Xia H, Hou T
Adv Sci (Weinh). 2022 Jan;9(3):e2102435. doi: 10.1002/advs.202102435. Epub 2021 Nov 26. PubMed Article

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