-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1
Hello Nah-- > > SystemError: xplor-nih error: unable to open output file > gb1_extended_3421.pdb > > ie., the initial Extended conformation not being able to be written but only > by 'some' of the processes which prompted my Question initially. Why > everything being same, only few processes have this problem ? Not sure - particularly without seeing your script. Also, which platform are you running on? It's possible that there's some contention among the processes for opening a file of the same name (but I have not seen this before). You might try removing the argument to genExtendedStructure. > > Also I noticed that the Seed is being same for all the structures (atleast > initially set by seed=3421). But, since the parallelization is implicit in > the Python StructureLoop (i am using a version of anneal.py from eginputs > dir)does this affect the Structure Calculation in anyway ? > The seed is incremented for each structure in StructureLoop. Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.6 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8+ <http://mailcrypt.sourceforge.net/> iD8DBQFIBh/CPK2zrJwS/lYRAmDbAJ43VvoiBzl0Y/vA5ew5pOwifAjwHACeOutn UZp6dIV4DeckAtiMbcow7io= =tl0r -----END PGP SIGNATURE-----
