VMD-L Mailing List
From: Remya Ann (remya.mathewskl_at_gmail.com)
Date: Fri May 04 2018 - 10:55:35 CDT
- Next message: John Stone: "Re: How to change the coordinates of the dummy atoms in readvarxyz"
- Previous message: John Stone: "Re: CellPack"
- Next in thread: John Stone: "Re: How to change the coordinates of the dummy atoms in readvarxyz"
- Reply: John Stone: "Re: How to change the coordinates of the dummy atoms in readvarxyz"
- Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]
Hi,
I use the 'readvarxyz' command to read multiple trajectories with varying
number/name in VMD.
I understand that the dummy atoms created are given the {0 0 0]
coordinates. But these show up in the simulation box which is not desired.
It seems as an overlapping particle.
I have 4 atom types and dummy for each gets generated in every trajectory
except the one with the maximum number of atoms. using atomselect didnt
work since I couldnt select atoms with particular coordinates. And
selecting each particle with its index is a tedious process as it changes
in each frame.
Is there a way to change the default coordinate of the dummy atom so that
it is outside the simulation box? Any sort of help is much appreciated.
Thanks,
-- Remya Ann Mathews K Doctoral Scholar Polymer Engineering and Colloid Science Lab Department of Chemical Engineering Indian Institute of Technology Madras
- Next message: John Stone: "Re: How to change the coordinates of the dummy atoms in readvarxyz"
- Previous message: John Stone: "Re: CellPack"
- Next in thread: John Stone: "Re: How to change the coordinates of the dummy atoms in readvarxyz"
- Reply: John Stone: "Re: How to change the coordinates of the dummy atoms in readvarxyz"
- Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]