> 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
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,
> >
> 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
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 4.5.3,
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