Hi, All,
I've found a bug in the NEMD calculation for viscosity. This has been
reviewed in *Hess's paper at JCP 116 209 2002.*
The version of gromacs I'm using is the development version. Notice
that this version correct a previous but of 4.5.3, where you uses NEMD, both
the term V(eq.
On 2011-01-19 18.36, Xiaohu Li wrote:
Hi, All,
I've found a bug in the NEMD calculation for viscosity. This has
been reviewed in /*Hess's paper at JCP 116 209 2002.*/
The version of gromacs I'm using is the development version.
Notice that this version correct a previous but of
Date: Wed, 19 Jan 2011 19:13:12 +0100
From: sp...@xray.bmc.uu.se
To: gmx-users@gromacs.org
Subject: Re: [gmx-users] Important: Bugs in NEMD calculation
On 2011-01-19 18.36, Xiaohu Li wrote:
Hi, All,
I've found a bug in the NEMD calculation for viscosity. This has
been
On 2011-01-19 20.43, Berk Hess wrote:
Date: Wed, 19 Jan 2011 19:13:12 +0100
From: sp...@xray.bmc.uu.se
To: gmx-users@gromacs.org
Subject: Re: [gmx-users] Important: Bugs in NEMD calculation
On 2011-01-19 18.36, Xiaohu Li wrote:
Hi, All,
I've found a bug in the NEMD
Date: Wed, 19 Jan 2011 20:52:13 +0100
From: sp...@xray.bmc.uu.se
To: gmx-users@gromacs.org
Subject: Re: [gmx-users] Important: Bugs in NEMD calculation
On 2011-01-19 20.43, Berk Hess wrote:
Date: Wed, 19 Jan 2011 19:13:12 +0100
From: sp...@xray.bmc.uu.se
To: gmx-users
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