I believe the last line of the paper is: "We have made the code used for this analysis available on the GitHub site: https://github.com/shirtsgroup/droplet-analysis."
On Thu, Jan 21, 2016 at 10:02 PM, HZJ <1047334...@qq.com> wrote: > Thanks. I have come across this paper. It introduce how to calculate this > angle. No code is provided with this > paper. Can they share this code? I use a smooth surface. > > > Best wishes! > > > > > > ------------------ Original ------------------ > From: "Michael Shirts";<mrshi...@gmail.com>; > Date: Fri, Jan 22, 2016 11:40 AM > To: "Discussion list for GROMACS users"<gmx-us...@gromacs.org>; > Cc: "gromacs.org_gmx-users"<gromacs.org_gmx-users@maillist.sys.kth.se>; > Subject: Re: [gmx-users] Contact_Angles_Calculation > > > > See: > > http://pubs.acs.org/doi/abs/10.1021/acs.langmuir.5b00842 > > For a study using GROMACS. They code can be downloaded (though it > might not be trivial to use). > > On Thu, Jan 21, 2016 at 6:32 PM, HZJ <1047334...@qq.com> wrote: >> Dear GMX users, >> >> >> Recently, I want to analyze the contact angle of a gas bubble adsorbed on a >> surface, during the simulation, >> the bubbule can move freely on the surface. I aim to calculate the contact >> angle for each frame. Did anyone >> do such analysis and suggest a simple way to do it? I read some paper, one >> method is to calculate the 2D density of the bubble, and then to fit the >> edges of the curve to a function type and then get the angle. It seems this >> method is simple only for one frame. Thanks! >> >> >> >> Best wishes! >> >> >> Dr. He >> -- >> Gromacs Users mailing list >> >> * Please search the archive at >> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! >> >> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists >> >> * For (un)subscribe requests visit >> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a >> mail to gmx-users-requ...@gromacs.org. > -- > Gromacs Users mailing list > > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > * For (un)subscribe requests visit > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a > mail to gmx-users-requ...@gromacs.org. > -- > Gromacs Users mailing list > > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > * For (un)subscribe requests visit > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a > mail to gmx-users-requ...@gromacs.org. -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.