Casey,Richard wrote:
Hi,
We've been able to merge a compound in a membrane (popc128) with
genbox -cp compound.pdb -cs popc128a.pdb -box 8 8 8 -o compound_in_popc128.pdb
-p compound.top
however it places the compound near the edge of the membrane. We would like to place the compound at other (various) locations in the membrane. Does anyone know how to do this?
Center the compound in the box first with editconf -c, or otherwise specify the
coordinates with editconf -center X Y Z.
-Justin
--------------------------------------------
Richard
_______________________________________________
gmx-users mailing list gmx-users@gromacs.org
http://www.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/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/mailing_lists/users.php
--
========================================
Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
_______________________________________________
gmx-users mailing list gmx-users@gromacs.org
http://www.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/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/mailing_lists/users.php