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Hi everyone,

I would love to have a script that does the following:

I have one file that looks like that:

ATOM 1 BB SER 1 1 -31.958 -25.125 -11.061 1.00 0.00
ATOM ...

Thank you all very much!

Finally I used the Perl script and it worked perfectly!

You made my day :-)

Have a nice evening,
Christine

Hi,

thank you for the fast help! This is pretty much, what the output should be. The only thing is the mean value. So, in the first line should be -1.5 in the 5th column (-1+(-2))/2=-1.5. Meaning,...

Hi everybody,

I have a file that looks like:

A B C D -1 0
E F G H -2 0
I J K L +1
M N O P -6

I would like to compare $5 of every line. If both values are negative, I calculate a mean...