[gmx-users] About support for infinite systems in cvs version

Wei Zhang zhangw at sinr.ac.cn
Fri Sep 19 19:18:00 CEST 2003


Dear David,

I don't see the support for infinite systems in the current CVS verion Gromacs works.

I simulated a carbon nanotube. I used periodic boundary condition. When I use the windows version 3.1.2, it runs fine. But when I use the CVS version and let pbc=full, it gives bad result. 
  

        Wei Zhang
        zhangw at sinr.ac.cn
          2003-09-20





More information about the gromacs.org_gmx-users mailing list