GitLab

Fixed errors with AMOEBA force field split between multiple XML files

[WIP] Precompute GBNeck terms

Eliminated dependence on numpy and scipy

Added functions to get per atom lab frame permanent dipoles and per atom total dipole moments for AMOEBA

Attempt to get travis working again on OS X

Eliminated warnings about unclosed files

Improved how AMOEBA identifies exceptions

Made AMOEBA API more consistent

Fixed code that checks SWIG version

Further optimization to template matching

Added check for illegal particle index

Added units classes to Python API docs

Fixed energy error for Drude particle at same location as its parent atom

<LennardJonesForce> tag in force fields