[gmx-users] Regarding g_wham options

Nitin Agrawal nitinyugalagrawal at gmail.com
Wed May 30 14:18:27 CEST 2012


When I am using the command -zprof0. it is not giving the desired result. I
am using it as

 g_wham -b 5000 -zprof0 -6.0 -it tpr_files.dat -if pullf_files.dat -o
profile_new1.xvg -hist histo_new1.xvg -unit kCal

but the lowest point in the graph is still -6.0 in the y axis and not set
to 0.0

Am i using the parameters wrong?

On Wed, May 30, 2012 at 1:42 PM, Nitin Agrawal
<nitinyugalagrawal at gmail.com>wrote:

> Thank you
>
>
> On Wed, May 30, 2012 at 1:39 PM, Justin A. Lemkul <jalemkul at vt.edu> wrote:
>
>>
>>
>> On 5/30/12 6:29 AM, Nitin Agrawal wrote:
>>
>>> Hi all,
>>>
>>> I want to set the lowest point in my curve as zero instead of negative
>>> number.
>>> Can anyone tell me which option to use to do that?
>>>
>>>
>> Set the desired value with -zprof0.
>>
>> -Justin
>>
>> --
>> ==============================**==========
>>
>> Justin A. Lemkul, Ph.D.
>> Research Scientist
>> Department of Biochemistry
>> Virginia Tech
>> Blacksburg, VA
>> jalemkul[at]vt.edu | (540) 231-9080
>> http://www.bevanlab.biochem.**vt.edu/Pages/Personal/justin<http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin>
>>
>> ==============================**==========
>> --
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>
>
>
> --
> Regards,
> Nitin Agrawal,
> Master's Student (Bioinformatics)
> University of Turku,Finland
> B.Tech (Biotechnology)
> National Institute of Technology,Durgapur,India
> Blog:http://notjustanyotherblog.blogspot.com/
>



-- 
Regards,
Nitin Agrawal,
Master's Student (Bioinformatics)
University of Turku,Finland
B.Tech (Biotechnology)
National Institute of Technology,Durgapur,India
Blog:http://notjustanyotherblog.blogspot.com/
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