Hi Dear Gromacs users, I would like to calculate the standard deviation (as the error bar) for dV/dlambda.xvg file. I used g_analyze command as the following:
g_analyze -f free0.9.xvg -av average_0.9 I got: set average *standard deviation* *std. dev. / sqrt(n-1) *… SS1 6.053822e+01 3.062230e+01 1.936724e-02 … Is the amount of in third (standard deviation) or fourth column (std. dev. / sqrt(n-1) ) better than to use as the error bar? I want to draw dG/d lambda via lambda and show error bar for free energy differences. Thanks in advance Afsaneh -- 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
