GitLab

4*(1<<30) evaluates to 0 so the check returns true on 2GB cards. Test runs fine on 2GB cards but requires over 4GB of system memory.

* Added HMR to make ApoA1 benchmark more stable

* Removed debugging code

* Fix errors on Python 3.9

* Revert changes to travis builds

* Improved documentation for LangevinMiddleIntegrator

* Fixed a unicode character that caused problems on Windows

* CCMA with a small number of constraints uses a single kernel

* Fixed compilation errors in kernel

* Fixed compilation errors in kernel

* Further optimizations to CCMA with few constraints

* Fixed range overflow with very large numbers of atoms

* More fixes to overflow with large numbers of atoms

* Fix test failures

* Updated to latest values for physical constants

* Updated documentation on physical constants

* Updated Python unit definitions

* Fixed constants in test case

* Added a comment

* Attempt at fixing Azure builds

* Fixed an incorrect path

Fixed typo in forcefield.py: 2DFunction -> 3DFunction

States can save integrator parameters

Add arguments needed by the new CUDA agents

Added new features to AmoebaVdwForce

Workaround for bug in GCC 8 on PPC

Added check for unsupported OpenCL implementation

* Use Python 3.8 for Mac build

* Another attempt at getting the Mac build to use Python 3

* Fixed syntax error

* More attempts at getting Python 3 on Mac

* More attempts at getting Python 3 on Mac

* More attempts at getting Python 3 on Mac

* More attempts at getting Python 3 on Mac