[gmx-users] g_dipole

[Justin A. Lemkul]

Nilesh Dhumal wrote:
> I used following command.
> 
> g_dipoles -f 6.trr -s 6.tpr -corr total -normalize NO -c
> 
> Its not working.
> 
> Its giving following error
> Invalid command line argument:
> NO
> 

With arguments listed as -[no]option, the proper argument is "-nooption" so in 
your case, -nonormalize.

-Justin

> Nilesh
> 
> 
> On Tue, February 15, 2011 7:57 am, David van der Spoel wrote:
>> On 2011-02-15 13.51, Nilesh Dhumal wrote:
>>
>>> Hello,
>>>
>>>
>>> I want to calculate dipole autocorrelation function without
>>> normalization. How can I calculate dipole autocorrelation function
>>> without normalization. I am using gromacs 4.0.7 version.
>>>
>>>
>>> Thanks
>>> Nilesh
>>>
>>>
>> g_dipoles -h
>>
>>
>> --
>> David van der Spoel, Ph.D., Professor of Biology
>> Dept. of Cell & Molec. Biol., Uppsala University.
>> Box 596, 75124 Uppsala, Sweden. Phone:	+46184714205.
>> spoel at xray.bmc.uu.se    http://folding.bmc.uu.se --
>> 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/Support/Mailing_Lists/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/Support/Mailing_Lists
>>
>>
>>
> 
> 

-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

========================================