Molecular dynamics of the ERRγ ligand-binding domain bound with agonist and inverse agonist
收藏Figshare2023-03-21 更新2026-04-08 收录
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https://figshare.com/articles/dataset/Molecular_dynamics_of_the_ERR_ligand-binding_domain_bound_with_agonist_and_inverse_agonist/22306747/1
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资源简介：
Moleucular dynamics simulation data of ERRγ bound with agonist and inverse agonist are given. <br> Trajectory files (.xtc) generated using gromacs for apo and ligand bound ERRγ are stored. <br> 100ps coordinates saved after removing PBC for 500ns simulations (.xtc) are given along with .tpr files.
提供机构：
Lee, Jun-Yeong; Radhakrishnan, Kamalakannan; Saudagar, Prakash; Gosu, Vijayakumar; Shin, Donghyun; Sasidharan, Santanu
创建时间：
2023-03-21
