[MMTK] Keep order of molecules
Fuchsan at students.uni-marburg.de
Mon Feb 9 13:51:13 UTC 2009
I have succesfully defined files which specify my molecule so that I
can add them easily to my universe using the universe.addObject(mol)
After completition of the simulation, I'd like to write a pdb file
which has the same atom order as in the MMTK-Inputfile. Unfortunately,
MMTK changes the order to somethin like c0, c01, c02,..,c10,..,n0, and
so on. How can I prevent MMTK from doing so?
Thanks for your help!
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