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Currently the data decreases in periodic repetition 6.5 -1.25 10.2804 6.5404 -1.25 10.4907 6.58081 -1.25 10.8087 6.62121 -1.25 10.4686 6.66162 -1.25 10.506 6.70202 -1.25 10.3084 6.74242 -1.25 9.68256 6.78283 -1.25 9.41229 6.82323 -1.25 9.43078 6.86364 -1.25 9.62408 6.90404 -1.25 9.23871...

It should be min(X,Y) to max(X,Y) 6.5 -1.25 10.2804 6.5 -1.21717 10.3285 etc No value must decrease in subsequent records. I need the data in R which requires incremantal X, Y ordering.

I've got 2D histogram data output 6.5 -1.25 10.2804 6.5404 -1.25 10.4907 6.58081 -1.25 10.8087 6.62121 -1.25 10.4686 6.66162 -1.25 10.506 6.70202 -1.25 10.3084 6.74242 -1.25 9.68256 6.78283 -1.25 9.41229 6.82323 -1.25 9.43078 6.86364 -1.25 9.62408 6.90404 -1.25 9.23871 6.94444 -1.25 9.4298...

Hi there, thanks, no it was really helpful as an outline. I will definitely give it a stab!

Could this be done in AWK?

My task is essentially to count the pairs and put the in the appropriate intervals. Maybe tcl is not the best language for this task.

I sorted phi and psi individually in Xmgrace and plotted two histograms. That is how I obtained the individual data. However, I would not like to look at the occurrence of dihedral pairs (phi, psi) and see the distribution of the pair. My data looks like this: frame phi psi 0 68.466774...

I currently have data of this form frame number phi psi 1 -87 65 2 -65 45 3 ... ... 4 5 ... Now, I can sort this data so that phi, psi values are ordered (from -180 to 180) and then convert this data to a histogram of...

Thanks a lot! Great

Hi, I wish to apply the following script to histogram a set of data I have http://www.perlmonks.org/?node_id=663280 However, when I run the script in the terminal I get the following error. user$ perl histogram Bareword "mxs" not allowed while "strict subs" in use at histogram line 30...