next up previous contents index
Next: 4.2 What happens when Up: 4 Loading A Molecule Previous: 4 Loading A Molecule

4.1 Babel interface

 

VMD can use the program  Babel, if installed, to translate a wide variety of different molecular data files into the PDB format. Babel, written by Pat Walters and Matt Stahl, can convert between many types of molecular data files. Not all of these have been tested for use with VMD, so your results may vary. Some data formats, such as XYZ, contain a series of coordinates. Babel converts these to a series of PDB files which VMD then reads as an animation. For more information about Babel, see ftp://joplin.biosci.arizona.edu/pub/Babel Presently VMD supports version 1.1b5 of Babel. Future versions of VMD will upgrade to support for version 2.0 of this program

  VMD at present has no provision for using Babel to convert the output PDB CRD, or DCD files to anything else (see sections S, and for information on writing output files).

The Babel-VMD interface uses two environment variables,  VMDBABELBIN and  VMDTMPDIR. The first specifies the absolute location for the Babel binary (i.e. it must include the name of the executable itself, such as /usr/local/bin/babel). The second defines the location for the temporary PDB files made by Babel.



Sergei Izrailev
Fri Jul 25 17:07:27 CDT 1997