GitLab

PDBxFile marks heterogens with HETATM

NonbondedForce can optionally apply periodic boundary conditions to exceptions

fix performance issue when use Drude force with velocity-verlet integrator

Add chain break when either auth_asym_id or label_asym_id changes

Fixed incorrect indexing in kernel

Replace nonstandard atom and residue names when loading PSF files

Implemented switchDistance option for GromacsTopFile

Fixed inconsistency between plaforms in constraints with CustomIntegrator

Catch exception when an OpenCL platform has no devices

Fixed error on CPU platform when forces disagree about whether the system is periodic

Windows tests on Azure

Updated simulation parameters in documentation and examples

Improved behavior of rigidWater option

Updates to documentation

Fixed error in BAOAB on CUDA and OpenCL

testInstallation: raise exception if large differences are observed

Update cl.hpp