All-atom molecular dynamics simulations of Synechocystis halorhodopsin (SyHR)
收藏NIAID Data Ecosystem2026-05-01 收录
下载链接：
https://zenodo.org/record/6526420
下载链接
链接失效反馈官方服务：
资源简介：
The trajectories of all-atom MD simulations of:
1) Cl--bound SyHR in the ground (GR) state (SyHR_monomer_GR_POPC_CHARMM36_200ns)
2) Cl--bound SyHR in the K state (SyHR_monomer_K_POPC_CHARMM36_200ns)
in the monomeric form in a POPC bilayer.
3) SO42--bound SyHR in the GR state (SyHR_trimer_GR_POPC_CHARMM36_500ns)
in the trimeric form in a POPC bilayer.
Simulations have been performed using the CHARMM36 force field, running with the GROMACS 2022 package.
创建时间：
2024-03-02
