[gmx-users] Test particle insertion method

[jinhong zhou]

Hi,Rafael,

Yes. I want to know how to prepare the input files for TPI method in
gromacs. I can't find any test set for it. Could you please kindly send me
an example?
Thanks a lot.

jinhong zhou

>Date: Sat, 23 Nov 2013 18:14:54 -0800
>From: "Rafael I. Silverman y de la Vega" <rsilverm at ucsc.edu>
>To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>Subject: Re: [gmx-users] Test particle insertion method
>Message-ID:
        <
>CAOrpqKpsUz9kDerCekiUASZJ2Ozv9pHAukEEuTob7tCxjte=_w at mail.>gmail.com<w at mail.gmail.com>
>
>Content-Type: text/plain; charset=ISO-8859-1

>What do you mean test files? Do you want to see how to alter the .top .gro
>and trajectory files?


>On Sat, Nov 23, 2013 at 4:28 PM, jinhong zhou <jinhongzhou87 at gmail.com
>>wrote:

> Hello,
>
> I am a new user of gromacs.
> I want to calculate the chemical potentials of some molecules, such as
> water. But I can't find any test files for "test particle insertion
> method".
> Is there anyone kind to send me some examples?
>
> Thanks a lot.
> --
> jinhong zhou


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