Re: [gmx-users] Fwd: What could be wrong with rdf plot?

2010-01-05 Thread XAvier Periole
bject: Re: [gmx-users] Fwd: What could be wrong with rdf plot? It is always better to keep the discussion in the list. Someone could benefit of it as well as you from others. From: Lum Nforbi Date: January 4, 2010 7:57:04 PM GMT+01:00 To: XAvier Periole Subject: Thank you for reply on RDF

RE: [gmx-users] Fwd: What could be wrong with rdf plot?

2010-01-04 Thread Dallas B. Warren
From: gmx-users-boun...@gromacs.org on behalf of XAvier Periole Sent: Tue 1/5/2010 6:33 AM To: Discussion list for GROMACS users Subject: Re: [gmx-users] Fwd: What could be wrong with rdf plot? It is always better to keep the discussion in the list. Someone could benefit of it as well as you from o

Re: [gmx-users] Fwd: What could be wrong with rdf plot?

2010-01-04 Thread XAvier Periole
or you have to find out our self, looking at the code or in the archive :)) Thank you, Lum Message: 3 Date: Sun, 3 Jan 2010 13:18:29 +0100 From: XAvier Periole Subject: Re: [gmx-users] Fwd: What could be wrong with rdf plot? To: Discussion list for GROMACS users Message-ID: <28fdb30b-7

Re: [gmx-users] Fwd: What could be wrong with rdf plot?

2010-01-03 Thread XAvier Periole
I am not sure somebody gave you an answer ... the first intense and probably very narrow pick is very likely due to the intramolecular OH distance. It should be around 0.1 nm, isn't it? On Jan 1, 2010, at 3:53 AM, Lum Nforbi wrote: -- Forwarded message -- From: Lum Nforbi D

[gmx-users] Fwd: What could be wrong with rdf plot?

2009-12-31 Thread Lum Nforbi
-- Forwarded message -- From: Lum Nforbi Date: Thu, Dec 31, 2009 at 12:33 PM Subject: What could be wrong with rdf plot? To: gmx-users@gromacs.org Dear all, I am currently analyzing a system of 2000 molecules of TIP3P water on which I performed a NPT simulation. The plot fo