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multiscale
lammps
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9c27548a5c4dd6e7126c0fb76b3a366a9f0bef6a
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Created with Raphaël 2.2.0
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update presets for USER-PLUMED package. fix typo.
replace faulty preprocessor logic
Merge pull request #1198 from akohlmey/next-patch-release
Merge pull request #1184 from DiscreteLogarithm/sdpd
patch 9Nov2018
Merge branch 'master' into sdpd to resolve merge conflicts
Merge pull request #1195 from jrgissing/bond/react-custom_edges
Merge pull request #1180 from gtribello/master
Merge pull request #1191 from akohlmey/msi2lmp-avoid-bad-topology
Merge pull request #1182 from junghans/pkgconfig_doc
include USER-SDPD package in list of user packages in conventional make
replace non-ASCII characters
improve logic and grammar of error messages
remove bogus single function and set single_enable = 0
remove dead code and avoid compiler warnings
use c++ style include files for c-library functions
ignore USER-SDPD files when installed
bond/react: allow custom update of charges near template edges
Merge pull request #32 from lammps/master
Merge pull request #1194 from ohenrich/user-cgdna
Merge branch 'master' into user-cgdna
Updated link to preprint article
Merge pull request #1189 from jrgissing/bond/react-custom_group
Merge pull request #1192 from julient31/master
update reference
Merge pull request #31 from lammps/master
do not generate illegal dihedrals, e.g. from 3-membered rings
cmake: switch plumed to full static mode
cmake: fix linking again plumed
correction to fix group property doc
broke smooth restarts at some point. fixed
various small changes and reformatting
Added check on fix modify for PLUMED to ensures that virial is calculated for group all
Added functionality to support fix modify for fix plumed
Added functionality to throw error when time step changes and PLUMED is being used
Got rid of some of the hard-coded units in the plumed interface
update bond/react examples
bond/react: convert group-ID to group-ID-prefix
download only the plumed-src package and include further tweaks to be compatible with plumed 2.5b
provide reference logfiles and move generated files to reference folder
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