Added pull coordinate geometry dihedral (angle)
commitf8f8d51df5ac73433c1d4ee10b61d11872aa3e7b
authorViveca Lindahl <vivecal@kth.se>
Wed, 10 Feb 2016 20:29:31 +0000 (10 21:29 +0100)
committerViveca Lindahl <vivecalindahl@gmail.com>
Fri, 18 Mar 2016 15:05:14 +0000 (18 16:05 +0100)
tree0a91befd94035ac7081a72f5342b560c14dd1a27
parent50f182aa3d1662916ef688eaf635817fafc35d99
Added pull coordinate geometry dihedral (angle)

How to use the new geometry is explained in the docs.

Change-Id: Ic5fc106df923857e5e94409583e3793dcd7f9fb8
docs/manual/special.tex
docs/user-guide/mdp-options.rst
src/gromacs/fileio/tpxio.cpp
src/gromacs/gmxana/gmx_wham.cpp
src/gromacs/gmxpreprocess/readpull.cpp
src/gromacs/math/vec.h
src/gromacs/mdtypes/md_enums.cpp
src/gromacs/mdtypes/md_enums.h
src/gromacs/mdtypes/pull-params.h
src/gromacs/pulling/pull.cpp
src/gromacs/pulling/pull_internal.h