[gmx-users] powercut command

Anshul Lahariya anshullahariya17 at gmail.com
Thu Apr 13 12:00:39 CEST 2017


dear das sir,

-cpi was already added to the command but my problem is not solved

On Thu, Apr 13, 2017 at 3:24 PM, Anshul Lahariya <anshullahariya17 at gmail.com
> wrote:

> error says, xtc file is not used for this option . plzz use trr, cpt, tng
>
>
> help me out
>
> On Thu, Apr 13, 2017 at 11:29 AM, Amir Zeb <zebamir85 at gmail.com> wrote:
>
>> please put this command line
>> gmx mdrun -v -s xxx.tpr -c xxx.gro -g xxx.log -e xxx.edr -cpi xxx.cpt -o
>> md_1_0.xtc
>>
>> good luck
>>
>> On Wed, Apr 12, 2017 at 10:42 PM, Anshul Lahariya <
>> anshullahariya17 at gmail.com> wrote:
>>
>> > My md was running. Suddenly power supply was cuts due to some reason
>> and my
>> > my MD stops..
>> > To continue my MD, I use command:-
>> >
>> >
>> > gmx mdrun -v -s 10ns.tpr -e 10ns.edr -g 10ns.log -10ns.xtc -cpi 10ns.cpt
>> > -cpo 10ns.cpt -append
>> >
>> >
>> >
>> > but shows error.
>> >
>> >
>> > Error in user input:
>> > Invalid command-line options
>> >     Unknown command-line option -md_1_0.xtc
>> >
>> > For more information and tips for troubleshooting, please check the
>> GROMACS
>> > website at http://www.gromacs.org/Documentation/Errors
>> > -------------------------------------------------------
>> > [root at dhcppc58 AhpE_MSH]#
>> >
>> >
>> >
>> > Plzz.. help me out....
>> > --
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>
>


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