On Sun, 5 Oct 2014 18:54:16 +0100, Kay Diederichs <[email protected]> wrote:
>>grep "^ATOM" filename.cif | awk '{print $15}' | awk '{s+=$1;} END {print
>>s/NR;}'
>>
>
>the problem with this is that it will break if there is any B-factor of 100 or
>higher, because then the blank will be missing ...
>
sorry, I didn't read properly - this would break with PDB files, but the
message was about CIF files - I didn't check their format.
Kay
