Add virtual site with one constructing atom
authorBerk Hess <hess@kth.se>
Tue, 23 Jun 2020 12:54:12 +0000 (12:54 +0000)
committerPaul Bauer <paul.bauer.q@gmail.com>
Tue, 23 Jun 2020 12:54:12 +0000 (12:54 +0000)
commit1e133618933739b9cc1d70572660b2fced3887af
tree1128798ff1666e2f2896eef4d8e349f3d4794e82
parent49d692c29401ff0b064b4ac8299ee7a426f355d6
Add virtual site with one constructing atom

Also fixed the order of the function type update table in tpxio.cpp.
docs/reference-manual/functions/interaction-methods.rst
docs/release-notes/2021/major/features.rst
src/gromacs/fileio/tpxio.cpp
src/gromacs/gmxlib/nrnb.cpp
src/gromacs/gmxlib/nrnb.h
src/gromacs/gmxpreprocess/convparm.cpp
src/gromacs/mdlib/vsite.cpp
src/gromacs/mdlib/vsite.h
src/gromacs/topology/ifunc.cpp
src/gromacs/topology/ifunc.h