Author: bugman Date: Thu Feb 18 17:08:35 2010 New Revision: 10743 URL: http://svn.gna.org/viewcvs/relax?rev=10743&view=rev Log: Added a few Gromacs QM/MM snapshots. This will be used for a stereochemistry analysis system test. Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/ 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R0.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R1.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R2.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R3.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R4.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R5.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S0.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S1.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S2.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S3.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S4.pdb 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S5.pdb [This mail would be too long, it was shortened to contain the URLs only.] Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R0.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R0.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R1.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R1.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R2.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R2.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R3.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R3.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R4.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R4.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R5.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/R5.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S0.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S0.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S1.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S1.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S2.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S2.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S3.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S3.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S4.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S4.pdb?rev=10743&view=auto Added: 1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S5.pdb URL: http://svn.gna.org/viewcvs/relax/1.3/test_suite/shared_data/structures/phthalic_acid/snapshots/S5.pdb?rev=10743&view=auto