MD simulation trajectories used in the paper "ABCA1 is an extracellular phospholipid translocase"
收藏DataCite Commons2022-06-15 更新2024-07-29 收录
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https://figshare.com/articles/dataset/MD_simulation_trajectories_used_in_the_paper_ABCA1_is_an_extracellular_phospholipid_translocase_/18095690/4
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资源简介：
MD simulation trajectories used in the paper "ABCA1 is an extracellular phospholipid translocase" <br> <strong>1. 10 us coarse-grained MD simulation files of ABCA1 (WT, K568A, 11CmutA)</strong>, (abca1_cgmd.zip) <br> 1-1. wt.gro 1-2. wt-set1-10us.trr 1-3. wt-set2-10us.trr 1-4. wt-set3-10us.trr <br> 1-5. k568A.gro 1-6. k568A-set1-10us.trr 1-7. k568A-set2-10us.trr 1-8. k568A-set3-10us.trr <br> 1-9. 11CmutA.gro 1-10. 11CmutA_set1_10us.trr 1-11. 11CmutA_set2_10us.trr 1-12. 11CmutA_set3_10us.trr <br> 1-13. readme.txt <br> <strong>2. 30 ns steered molecular dynamic simulation file (slow pulling) </strong>(abca1_smd.zip)<br> <br> 2-1. smd.psf 2-2. 30ns.dcd 2-3. readme.txt <br> <br> <strong>3. 0.79 ns steered molecular dynamic simulation file (fast pulling)</strong> (abca1_smd2.zip)<br> 3-1. smd2.psf 3-2. 0.79ns.dcd 3-3. readme.txt
提供机构：
figshare
创建时间：
2022-06-14
