[gmx-users] Re: tutorial for ionic liquid

[Vitaly V. Chaban]

Hi Catarina,

This file contains the parameters for MD run, e.g. timestep, number of
steps, etc.

Good luck with IL,
Vitaly

-- 
Vitaly V. Chaban, Ph.D.
http://www-rmn.univer.kharkov.ua/chaban.html



On Thu, Feb 4, 2010 at 2:39 PM, Catarina Nunes <cata.nunes at gmail.com> wrote:
> Sorry Vitaly,
> Can you tell me what means a file mdp?
> Thank you.
> Catarina
>
> Hello Vitaly,
> I have a tutorial for ionic liquids of [BMIM] [PF6] but i can´t run it
>
>
> 2010/2/1 Vitaly V. Chaban <vvchaban at gmail.com>:
>>> Dear all,
>>> Do you have any tutorial for ?
>>> Best regards
>>> Catarina
>>
>> I have worked with MD of RTILs quite a lot. So if you have got
>> concrete questions, you can probably ask me directly.
>>
>>
>> Vitaly V. Chaban, Ph.D.
>> http://www-rmn.univer.kharkov.ua/chaban.html
>>