Re: AMBER: pair distribution function

From: Thomas Cheatham III <>
Date: Thu, 14 Jun 2007 17:41:51 -0600 (Mountain Daylight Time)

> i need help on calculating rdf for my system using PTRAJ
> 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)

I am not able to reproduce this with my amber9 version of ptraj or with
the older ptraj available on the WWW; what version are you using? Where
is it core dumping (before or after reading in all the frames)?

-- tec3
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Received on Sun Jun 17 2007 - 06:07:26 PDT
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