8 Commits

Author	SHA1	Message	Date
Evan Pretti	50f9085ca0	Always safely save checkpoints and states when filenames are given	2025-07-24 17:00:25 -07:00
Peter Eastman	b7ee3022b0	Added option for CheckpointReporter to save States (#3252) ... * Added option for CheckpointReporter to save States * Try to fix test failure on Windows	2021-09-19 17:36:33 -07:00
Peter Eastman	e53bdc5eab	Top level Python module is now "openmm" (#3000) ... * Top level Python module is now "openmm" * Updated module names in examples * Updated module names in documentation * Updated module in CI scripts * Added deprecation warning	2021-02-01 09:40:37 -08:00
Robert McGibbon	23143e8241	Eliminate extra warning about overriding the warning level ... Clean up Fix OpenCL platform on low-end devices Close file before deleting in TestAmberPrmtopFile.py Close PDBx file before deleting to fix windows test failure in TestPDbxFile.py Fix test checkpoint reporter close file before repoening Add bytes typemap Update appveyor.yml Fix exit status Supress 4305 and 4244 warnings Print the last failed tests output Make numpy optional in test Improve scipy skip too Refactor TestCheckpointReporter.py to not require numpy test on the proper file Remove annoying -V	2015-08-12 23:08:17 -07:00
Robert McGibbon	dbfc30241b	Fix test checkpoint reporter close file before repoening	2015-08-12 17:53:06 -07:00
Robert McGibbon	c43eb6a106	Enhance the test to ensure that the checkpoint can be loaded correctly	2014-03-27 18:56:25 -07:00
Robert McGibbon	b4a9823876	typo fix -- thanks @peastman	2014-03-27 18:44:44 -07:00
Robert McGibbon	1e7300bba1	add test	2014-03-27 03:47:52 -07:00