Useful program of the day: pdbcat

http://www.ks.uiuc.edu/Development/MDTools/pdbcat/

A tool to convert from the nasty column / fixed-width ‘fortran like’ PDB fileformat to a more reasonable unix-like whitespace delimited fields, and back again.

I had to add ‘using namespace std; ’ to line 24 of pdbcat.C to get it to compile (otherwise “error: ‘cerr’ was not declared in this scope”).

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Jarvist Moore Frost
Electronic structure theory