PROTECTED]
<mailto:[EMAIL PROTECTED]>
[mailto:[EMAIL PROTECTED]
<mailto:[EMAIL PROTECTED]>]
> On Behalf Of Mark Abraham
> Sent: Sunday, November 11, 2007 9:04 AM
> To: Discussion list for GROMACS users
> Subject: Re: [gmx-users] force=nan in frame 0
>
>
> dong
TED]>
To: Discussion list for GROMACS users
Sent: Monday, November 12, 2007 2:33:38 PM
Subject: Re: [gmx-users] force=nan in frame 0
how do you turn off the interactions? e.g. setting rvdw=0 doesn't mean
turning of vdw interactions.
Regards,
Yang Ye
On 11/13/2007 12:55 AM, dongsheng
11, 2007 9:04 AM
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] force=nan in frame 0
dongsheng zhang wrote:
Dear Mark,
Thank you for your reply. I have used gromacs before. In fact, I have
built this FF before, and using it successfully. My old computer was
crashed, so I nee
sheng
-Original Message-
From: [EMAIL PROTECTED] [mailto:[EMAIL PROTECTED]
On Behalf Of Mark Abraham
Sent: Sunday, November 11, 2007 9:04 AM
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] force=nan in frame 0
dongsheng zhang wrote:
> Dear Mark,
>
> Thank you for your
dongsheng zhang wrote:
Dear Mark,
Thank you for your reply. I have used gromacs before. In fact, I have built
this FF before, and using it successfully. My old computer was crashed, so I
need to do it again. The potential energies looked fine in the md.log. Even
I turn off all potentials. I stil
Dear Mark,
Thank you for your reply. I have used gromacs before. In fact, I have built
this FF before, and using it successfully. My old computer was crashed, so I
need to do it again. The potential energies looked fine in the md.log. Even
I turn off all potentials. I still get the initial foce =
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