Dear all I am on the final step of MD simulation of membrane protein . the final mdrun has successfully completed after that I have filtered the water from the system .next step is to convert it in final pdb to view it in pymol for this I am using "trjconv" in this step I have to select a group from this option-
Group 0 ( System) has 419010 elements Group 1 ( Protein) has 9902 elements Group 2 ( Protein-H) has 7778 elements Group 3 ( C-alpha) has 1000 elements Group 4 ( Backbone) has 3000 elements Group 5 ( MainChain) has 4000 elements Group 6 (MainChain+Cb) has 4922 elements Group 7 ( MainChain+H) has 4961 elements Group 8 ( SideChain) has 4941 elements Group 9 ( SideChain-H) has 3778 elements Group 10 ( Prot-Masses) has 9902 elements Group 11 ( Non-Protein) has 409108 elements Group 12 ( DMPC) has 5520 elements Group 13 ( SOL) has 403578 elements Group 14 ( NA+) has 10 elements Group 15 ( Other) has 409108 elements Select a group: for protein with lipid bilayer which group is suitable can anyone suggest me? Becoz a/c to my opinion in group 0 there may be water also but I want to remove water . so please if anyone have idea about this please suggest me . thanks a lot. Nitu Sharma.
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