GaMD simulations for the R291A-A2AR-mini-Gs
收藏NIAID Data Ecosystem2026-05-02 收录
下载链接：
https://figshare.com/articles/dataset/GaMD_simulations_for_the_R291A-A2AR-mini-Gs/28079807
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资源简介：
Topology file: sys.prm (AMBER format)
Initial coordinate file: sys.pdb
Initial coordinate file without lipid, ions and water: sys-protein.pdb
GaMD equilibration input file: md.in
GaMD production input file: md-restart.in
Final snapshot of GaMD simulations (2000ns):
run1-2us.pdb (simulation 1);
run2-2us.pdb (simulation 2);
run3-2us.pdb (simulation 3).
创建时间：
2024-12-23
