# Log file for summarize_Sugr-Bak_rmsd for site 12 begun at 02:04:38, Thursday, 31 December, 2014 # # The contents of the input file follow. # # #!/bin/bash # # # This is the setup file for making cpptraj input files for analyzing all the # # data from these runs. # # ## First, indicate which run this is # # # IAM="0VA" # 0VA is glycam-speak for alpha-D-galnac # # ## Now, some info about the runs # MAXRUNS=32 # The total number of simulations performed # SETS=2 # How many duplicate sets? # SETSIZE=16 # How large was each set (should be MAXRUNS/SETS) # # # The runset identity is d4g NR is 32 ; NS is 16 ; SETS is 2 ============================================================ ========= Information regarding numbers of frames ========= ============================================================ Structure Index Frames Overall Run 1 Run 2 Run 3 Run 4 Run 5 Run 6 Run 7 Run 8 Run 9 Run 10 Run 11 Run 12 Run 13 Run 14 Run 15 Run 16 Run 17 Run 18 Run 19 Run 20 Run 21 Run 22 Run 23 Run 24 Run 25 Run 26 Run 27 Run 28 Run 29 Run 30 Run 31 Run 32 1 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 2 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 3 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 4 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 5 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 6 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 7 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 8 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 9 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 10 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 11 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 12 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 13 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 14 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 15 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931 16 317739 9951 9960 9909 9942 9267 9908 9951 9251 9936 9946 9377 9928 12820 9913 9929 9935 9950 9940 9403 9925 9954 9392 9933 9950 9948 9922 9902 9945 9914 9908 9899 9931