11 Commits

Author	SHA1	Message	Date
Axel Kohlmeyer	34cb4027df	make formatting comment consistent	2017-01-11 07:46:07 -05:00
Axel Kohlmeyer	f32819dd10	added tweak to write out the command line used for the conversion to the beginning of the LAMMPS input	2016-10-05 18:13:46 -04:00
Axel Kohlmeyer	6e719f2d94	remove trailing whitespace	2016-10-03 07:07:28 -04:00
Axel Kohlmeyer	45d2cc2895	permission update for ch2lmp tool folder	2016-10-03 07:03:42 -04:00
Axel Kohlmeyer	3b94627dfe	properly handle -nohints flag, make -cmap flag take version as option. step version number	2016-10-03 06:52:30 -04:00
Axel Kohlmeyer	c2e11dffa2	import updated charmm2lammps.pl script from Rober Latour	2016-10-02 20:33:20 -04:00
sjplimp	8a6e5ed3ce	git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15637 f3b2605a-c512-4ea7-a41b-209d697bcdaa	2016-09-23 22:59:43 +00:00
sjplimp	863a3d3319	git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15163 f3b2605a-c512-4ea7-a41b-209d697bcdaa	2016-06-14 13:59:39 +00:00
sjplimp	bfa988207e	git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14448 f3b2605a-c512-4ea7-a41b-209d697bcdaa	2016-01-15 15:39:44 +00:00
pscrozi	b8fdf06262	Bug fix from Pieter in 't Veld for charmm2lammps.pl script. Changed AddMass() to use correctly. ... git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@211 f3b2605a-c512-4ea7-a41b-209d697bcdaa	2007-01-09 15:05:41 +00:00
sjplimp	60c7f745b9	git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@27 f3b2605a-c512-4ea7-a41b-209d697bcdaa	2006-09-27 19:51:49 +00:00