[gmx-users] trr file in VMD

Mark Abraham Mark.Abraham at anu.edu.au
Mon Oct 12 03:40:25 CEST 2009


Paymon Pirzadeh wrote:
> I did that but, it did not work! I just get a constant color.

At the very least you would need to choose a representation that would 
colour by velocities. I don't know whether VMD can do that, or read .trr 
velocities in the first place, however. You might be better served 
asking this question on the VMD mailing list.

Mark

> On Sun, 2009-10-11 at 18:27 -0700, Amit Choubey wrote:
>> yes you can do that by opening the gro file and then loading the .trr
>> file .
>>
>> amit
>>
>> On Sun, Oct 11, 2009 at 6:22 PM, Paymon Pirzadeh
>> <ppirzade at ucalgary.ca> wrote:
>>         Hello,
>>         How can we use the trr file in VMD? I thought since we ask in
>>         the mdp
>>         file to output the velocities, then in VMD we should be able
>>         to see
>>         molecules colored based on their velocities through the
>>         trajectory
>>         options. Am I correct?
>>         
>>         Payman
>>         
>>         _______________________________________________
>>         gmx-users mailing list    gmx-users at gromacs.org
>>         http://lists.gromacs.org/mailman/listinfo/gmx-users
>>         Please search the archive at http://www.gromacs.org/search
>>         before posting!
>>         Please don't post (un)subscribe requests to the list. Use the
>>         www interface or send it to gmx-users-request at gromacs.org.
>>         Can't post? Read
>>         http://www.gromacs.org/mailing_lists/users.php
>>
>> _______________________________________________
>> gmx-users mailing list    gmx-users at gromacs.org
>> http://lists.gromacs.org/mailman/listinfo/gmx-users
>> Please search the archive at http://www.gromacs.org/search before posting!
>> Please don't post (un)subscribe requests to the list. Use the 
>> www interface or send it to gmx-users-request at gromacs.org.
>> Can't post? Read http://www.gromacs.org/mailing_lists/users.php
> 
> _______________________________________________
> gmx-users mailing list    gmx-users at gromacs.org
> http://lists.gromacs.org/mailman/listinfo/gmx-users
> Please search the archive at http://www.gromacs.org/search before posting!
> Please don't post (un)subscribe requests to the list. Use the 
> www interface or send it to gmx-users-request at gromacs.org.
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php
> 



More information about the gromacs.org_gmx-users mailing list