hi everybody
i need help on calculating rdf for my system using
PTRAJ
here's the command
radial rdf.out 0.05 10.0 :WAT.O :7.CA
if i used 0.05 as the width of the bin, the program
crashed (core dumped)
if i increased the width to 0.2 only it will work, but
it's too large
can somebody help me to solve this problem since i
want to calculate it using smaller bin width
thanks in advance
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Received on Sun Jun 17 2007 - 06:07:10 PDT
