VMD-L Mailing List
From: FX (fxcoudert_at_gmail.com)
Date: Wed Nov 20 2013 - 18:00:44 CST
> In case you manage to build vmd on your Mac and want to write your on patch
Well, I think replacing the lines (in MeasureSymmetry.C) with:
> if (sel->selected>maxnatoms && vmd_random()>maxnatoms/sel->selected)
> if (sel->selected>maxnatoms && vmd_random() % sel->selected < maxnatoms)
should work, but I canít test it for now. If you (or John or someone else) can put that into a build, and check on my test molecule (https://dl.dropboxusercontent.com/u/52398724/toto.xyz) that it recognizes the D2h symmetry correctly.