Fixed bug 381 by adding the number of the first atom in the charged group
commite27610651897a20c526c826b411fc4697b0f9992
authorDavid van der Spoel <spoel@leyster.bmc.uu.se>
Wed, 2 Jun 2010 13:46:59 +0000 (2 15:46 +0200)
committerDavid van der Spoel <spoel@leyster.bmc.uu.se>
Wed, 2 Jun 2010 13:46:59 +0000 (2 15:46 +0200)
tree9c9f21dd5a9ef0da9c277e6eb82356356ec12684
parent5399e648a1e6c4af21e3524ce12cf79d59a6c439
Fixed bug 381 by adding the number of the first atom in the charged group
to the name of the charged group. This should be unique now. For the example
in bugzilla g_saltbr now happily creates > 40000 unique output files.
src/tools/gmx_saltbr.c