[gmx-users] g_density?
minnale
minnale_gnos at rediffmail.com
Fri Oct 31 19:24:48 CET 2008
Thanks Justin for your response just glance below
>> Hi all,
>> I have small doubt on g_density, The bilayer thickness can be estimated by calculating density profile here I have calculated density for different groups in lipid system by g_density command.
>>
>> The POPC density profile x-axis(z-nm) vs y-axis(density), it looks "M" shape what is it mean first high and second high peak exactly?
>
>Which axis are you analyzing? "x-axis(z-nm)" makes no sense to me. Is your bilayer in the x-y plane (the canonical view), or does it have some other orientation?
I am considering only z-axis but I am plotting these values on X-axis in gnuplot.
>Your output also depends on what you've analyzed. Was it the bilayer as a whole? Just acyl chains? Headgroups?
I am calculating density of Head groups, choline, water and system separately later all these including in a single graph.
what is "M" shape peak refers?
Could clear my doubt.
Thanks in advance.
>Whatever it is that you've analyzed, the output corresponds to the density (kg/m^3) of that species at that point along the box dimension.
>
>>My idea is based on literature survey first peak tells one half of the bilayer density and other peaks tells remain half of the bilayer density.am I right?
>>
>
>So you're saying that the overall bilayer density should be the sum of the two peaks you're seeing? I guess the proper interpretation will depend on the answers to the questions I've posed above.
>
>-Justin
>
>>Any suggestions would be appreciated.
>>
>>Thanks in adavance
>>
>>
>>
>>Black578x38_banner2.gif <http://adworks.rediff.com/cgi-bin/AdWorks/click.cgi/www.rediff.com/signature-home.htm/1050715198@Middle5/2606998_2599290/2602379/1?PARTNER=3&OAS_QUERY=null>
>>
>>
>>------------------------------------------------------------------------
>>
>>_______________________________________________
>>gmx-users mailing list gmx-users at gromacs.org
>>http://www.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
>
>-- ========================================
>
>Justin A. Lemkul
>Graduate Research Assistant
>Department of Biochemistry
>Virginia Tech
>Blacksburg, VA
>jalemkul[at]vt.edu | (540) 231-9080
>http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
>
>========================================
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20081031/25d44c78/attachment.html>
More information about the gromacs.org_gmx-users
mailing list