On Mon, Oct 28, 2013 at 7:56 PM, Xu Dong Huang <xudonghm...@gmail.com>wrote:
> Hello, > > I have couple objectives as part of an analysis of my simulated system. > And I would like some opinions on the tools to use to achieve it. > > I have the following interest in my system: > 1) Find the probability distribution (density) of bond angle on my > molecule between (i.e atom 12, 2,3 , 13, etc) as a function of time step, > essentially, the equilibrium angle. [would I use g_chi for such analysis? ] > Summary of available tools in manual 7.4 and 8 - good place to look first. Probably you want g_angle. > 2) I want the above result in an excel spreadsheet, is there a way to > obtain it as a spreadsheet? Or I can only get a plot representation as a > function of time? > http://www.gromacs.org/Documentation/How-tos/Graphing_Data Mark > Please share your expertise and opinions. > > Thank you. > > Xu Huang > > > -- > gmx-users mailing list gmx-users@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-requ...@gromacs.org. > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > -- gmx-users mailing list gmx-users@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-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
