Commits · 3b7ebbb8dfe808265ab29fc30c04fe79b5ca0926 · multiscale / lammps

Nov 12, 2018
- new hyper examples · 3b7ebbb8
  Steve Plimpton authored 6 years ago
  
  3b7ebbb8
- hyper example dir · d7a479d2
  Steve Plimpton authored 6 years ago
  
  d7a479d2
- more updates to hyper docs · 0c8ce199
  Steve Plimpton authored 6 years ago
  
  0c8ce199
- updates to hyper doc pages · 4a6f088c
  Steve Plimpton authored 6 years ago
  
  4a6f088c
- changes to prd command doc page · 56598fcd
  Steve Plimpton authored 6 years ago
  
  56598fcd
- more edits to hyper docs · 265c11dc
  Steve Plimpton authored 6 years ago
  
  265c11dc
- doc files in wrong dir · d6631266
  Steve Plimpton authored 6 years ago
  
  d6631266
- global/local hyperdynamics src and doc files · fbd610b8
  Steve Plimpton authored 6 years ago
  
  fbd610b8
Nov 09, 2018
- Merge pull request #1198 from akohlmey/next-patch-release · 1651a21f
  Axel Kohlmeyer authored 6 years ago
  
  Patch release 9 November 2018
  Unverified
  
  1651a21f
Nov 08, 2018
- Merge pull request #1184 from DiscreteLogarithm/sdpd · cbae3b5a
  Axel Kohlmeyer authored 6 years ago
  
  add USER-SDPD package for Smoothed Dissipative Particle Dynamics
  Unverified
  
  cbae3b5a
- patch 9Nov2018 · f2a29880
  Axel Kohlmeyer authored 6 years ago
  
  f2a29880
- Merge branch 'master' into sdpd to resolve merge conflicts · e0955f64
  Axel Kohlmeyer authored 6 years ago
  
  # Conflicts: # cmake/CMakeLists.txt # src/Makefile
  e0955f64
- Merge pull request #1195 from jrgissing/bond/react-custom_edges · 3681bc85
  Axel Kohlmeyer authored 6 years ago
  
  Bond/react: charge update for custom edges
  Unverified
  
  3681bc85
- Merge pull request #1180 from gtribello/master · a6e9b992
  Axel Kohlmeyer authored 6 years ago
  
  Add natively supported PLUMED interface to LAMMPS
  Unverified
  
  a6e9b992
- Merge pull request #1191 from akohlmey/msi2lmp-avoid-bad-topology · 893a51ce
  Axel Kohlmeyer authored 6 years ago
  
  Dihedral generation bugfix for msi2lmp
  Unverified
  
  893a51ce
- Merge pull request #1182 from junghans/pkgconfig_doc · 80ee0848
  Axel Kohlmeyer authored 6 years ago
  
  liblammps.pc: add some more documentation
  Unverified
  
  80ee0848
Nov 07, 2018
- include USER-SDPD package in list of user packages in conventional make · bbb37113
  Axel Kohlmeyer authored 6 years ago
  
  bbb37113
- replace non-ASCII characters · a1e8992e
  Axel Kohlmeyer authored 6 years ago
  
  a1e8992e
- improve logic and grammar of error messages · baa7b705
  Axel Kohlmeyer authored 6 years ago
  
  baa7b705
- remove bogus single function and set single_enable = 0 · 2d12260a
  Axel Kohlmeyer authored 6 years ago
  
  2d12260a
- remove dead code and avoid compiler warnings · 31277349
  Axel Kohlmeyer authored 6 years ago
  
  31277349
- use c++ style include files for c-library functions · df232c1c
  Axel Kohlmeyer authored 6 years ago
  
  df232c1c
- ignore USER-SDPD files when installed · bdf73f7a
  Axel Kohlmeyer authored 6 years ago
  
  bdf73f7a
- bond/react: allow custom update of charges near template edges · 84fcf01b
  jrgissing authored 6 years ago
  
  also, fixes a bug introduced in PR #1189, when not using stabilization
  84fcf01b
- Merge pull request #32 from lammps/master · cc0d685e
  Jacob Gissinger authored 6 years ago
  
  rebase
  Unverified
  
  cc0d685e
Nov 06, 2018
- Merge pull request #1194 from ohenrich/user-cgdna · 5196fa37
  Axel Kohlmeyer authored 6 years ago
  
  Update reference for USER-CGDNA
  Unverified
  
  5196fa37
- Merge branch 'master' into user-cgdna · 4e625325
  Oliver Henrich authored 6 years ago
  
  4e625325
- Updated link to preprint article · 562296bd
  Oliver Henrich authored 6 years ago
  
  562296bd
- Merge pull request #1189 from jrgissing/bond/react-custom_group · 91c4ef6f
  Axel Kohlmeyer authored 6 years ago
  
  Bond/react custom group support
  Unverified
  
  91c4ef6f
- Merge pull request #1192 from julient31/master · f46d6a43
  Axel Kohlmeyer authored 6 years ago
  
  update reference for SPIN package
  Unverified
  
  f46d6a43
- update reference · cb828e95
  araven authored 6 years ago
  
  cb828e95
- Merge pull request #31 from lammps/master · ed77701e
  Jacob Gissinger authored 6 years ago
  
  rebase
  Unverified
  
  ed77701e
- do not generate illegal dihedrals, e.g. from 3-membered rings · 7ed6cab0
  Axel Kohlmeyer authored 6 years ago
  
  7ed6cab0
Nov 05, 2018
- cmake: switch plumed to full static mode · ce7f76de
  Christoph Junghans authored 6 years ago
  
  ce7f76de
- cmake: fix linking again plumed · 58d2f0cc
  Christoph Junghans authored 6 years ago
  
  58d2f0cc
- correction to fix group property doc · ab7aa9df
  jrgissing authored 6 years ago
  
  ab7aa9df
- broke smooth restarts at some point. fixed · 6d1ea2d0
  jrgissing authored 6 years ago
  
  6d1ea2d0
- various small changes and reformatting · a3ca177d
  Axel Kohlmeyer authored 6 years ago
  
  - add memory usage estimator - test against varying number of atoms - test against non-consecutive atom tags - test for 32-bit overflow in number of atoms - test for 32-bit overflow in timestep - reduce tail correction error to warning - more LAMMPS style formatting of the source code - remove trailing whitespace - avoid leaking memory from allocated arrays for masses/charges/tags
  a3ca177d
Nov 04, 2018
- Added check on fix modify for PLUMED to ensures that virial is calculated for group all · a3c0fe77
  Gareth Tribello authored 6 years ago
  
  a3c0fe77
- Added functionality to support fix modify for fix plumed · a051d61e
  Gareth Tribello authored 6 years ago
  
  a051d61e