- 17 Dec, 2014 1 commit
-
-
peastman authored
-
- 16 Dec, 2014 1 commit
-
-
peastman authored
-
- 11 Dec, 2014 1 commit
-
-
peastman authored
-
- 10 Dec, 2014 1 commit
-
-
peastman authored
-
- 09 Dec, 2014 1 commit
-
-
peastman authored
-
- 03 Dec, 2014 1 commit
-
-
peastman authored
-
- 02 Dec, 2014 2 commits
- 26 Nov, 2014 5 commits
- 19 Nov, 2014 11 commits
-
-
peastman authored
Updated instructions on running the test installation script
-
peastman authored
-
peastman authored
Conda testing
-
Jason Swails authored
-
Jason Swails authored
run_tests to TestingError so users only ever have one exception to catch.
-
Jason Swails authored
-
Jason Swails authored
-
Jason Swails authored
SyntaxWarning otherwise). So move those imports back to the module level and save any error messages for when the tests are actually run (if ever). python -m simtk.testInstallation runs the tests, whereas python -c "import simtk.testInstallation" does not.
-
Jason Swails authored
import of the new testInstallation module and a command to run the tests. This way, we only have one place where we need to maintain this code, yet the current workflow of "run testInstallation.py" still works.
-
Jason Swails authored
Also copy the test PDB file to the data/ directory, since we rather need it...
-
peastman authored
Workaround for CUDA bug
-
- 18 Nov, 2014 12 commits
-
-
peastman authored
-
peastman authored
DrudeForce did not implement getBondedParticles()
-
peastman authored
-
peastman authored
Added error codes from CUDA 5.0
-
peastman authored
Fixep
-
peastman authored
-
peastman authored
Install benchmark.py script
-
peastman authored
-
Jason Swails authored
-
Jason Swails authored
-
Jason Swails authored
most important and we don't want false positives.
-
Jason Swails authored
At some point, at least, TP4 was the residue label for water (I think tleap currently translates most of the water residue labels to WAT, but there are at least some -- like $AMBERHOME/test/tip4p/prmtop -- that use older labels).
-
- 17 Nov, 2014 2 commits
-
-
peastman authored
Remove what appears to be a debug message.
-
Jason Swails authored
-
- 14 Nov, 2014 2 commits