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ls1mardyn
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ls1-mardyn
ls1-MarDyn is a massively parallel Molecular Dynamics (MD) code for large systems. Its main target is the simulation of thermodynamics and nanofluidics. ls1-MarDyn is designed with a focus on performance and easy extensibility.
http://www.ls1-mardyn.de
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All-options reminder
#344
FG-TUM
closed
6 days ago
1
Creeping complexity in `CMakeLists` due to folder structure
#343
amartyads
opened
3 weeks ago
0
Modernize clang-format file
#342
HomesGH
opened
3 weeks ago
2
Use proper exit codes
#341
HomesGH
opened
3 weeks ago
6
Improvements of bhfmm
#340
HomesGH
opened
3 weeks ago
0
Reflecting boundaries
#339
amartyads
opened
1 month ago
9
Refactor Communication Classes
#338
FG-TUM
opened
1 month ago
0
Replace raw with smart pointers
#337
HomesGH
closed
3 weeks ago
3
Add sampling of kinetic energy to ResultWriter
#336
HomesGH
closed
1 month ago
0
Slightly different results for SEQ and PAR
#335
HomesGH
opened
2 months ago
0
Replace Simulation::exit with mardyn_exit
#334
HomesGH
closed
2 months ago
2
Fix of mixing rules
#333
HomesGH
closed
2 months ago
4
Cleanup of readers
#332
HomesGH
opened
2 months ago
1
Mixing rules not implemented thoroughly
#331
HomesGH
closed
2 months ago
0
Fix CITATION.cff
#330
FG-TUM
closed
3 months ago
0
New collcommobj
#329
mikesoehner
opened
3 months ago
0
Add molecule-wise virial correction
#328
HomesGH
closed
3 months ago
0
Scalable check for duplicated particle IDs
#327
HomesGH
opened
4 months ago
0
Improvements of MaxCheck plugin
#326
HomesGH
closed
4 months ago
1
StaticIrregDD: remove CSV requirement, add XML reading capabilities
#325
amartyads
closed
3 months ago
0
Wrong input parsing of static irregular domain decomposition
#324
HomesGH
closed
3 months ago
0
corrected comment
#323
amartyads
closed
4 months ago
0
Fix bug in static code analysis and add exit codes
#322
HomesGH
closed
4 months ago
2
Load Balancing is slower
#321
jose-pinzon0407
opened
4 months ago
4
Exit codes of static code analysis
#320
HomesGH
closed
4 months ago
0
Fixes regarding component ID
#319
HomesGH
opened
4 months ago
1
Change 0/1 to true/false in xml configs
#318
HomesGH
closed
4 months ago
2
Booleans in examples as 0/1
#317
HomesGH
closed
4 months ago
0
Spherical thermostat
#316
JakNiem
closed
4 months ago
0
Bug in Basis.cpp regarding component ID
#315
HomesGH
opened
4 months ago
0
Revision of some python scripts in ppls1
#314
HomesGH
closed
4 months ago
0
Set initial simulation time step earlier
#313
HomesGH
closed
4 months ago
1
Add names to site in xml
#312
HomesGH
closed
2 months ago
0
Fix xml parser attribute parsing
#311
cniethammer
closed
4 months ago
0
XML parser's getNodeValue() returns wrong number of attributes
#310
cniethammer
closed
4 months ago
0
Add log output for site parameters when reading xml input configuration
#309
cniethammer
closed
4 months ago
0
Fix and improvement of Logger
#308
HomesGH
closed
3 months ago
0
Add output of side parameters
#307
HomesGH
closed
4 months ago
2
Use MPI_Init_thread if OpenMP is enabled
#306
cniethammer
opened
4 months ago
1
New plugin: EnergyRAPL
#305
rubenhorn
closed
5 months ago
1
The use of testcube-dense-fs results in a std::out_of_range error.
#304
GuoYongFa
opened
5 months ago
1
Print whether the parallelization workload is reasonable
#303
FG-TUM
opened
6 months ago
2
Update github C/C++ CI for ls1 action to use checkout@v4
#302
cniethammer
closed
6 months ago
0
Energy tuning feature from autopas
#301
manishmishra6016
closed
6 months ago
0
Fix quaternion default initialisation
#300
cniethammer
opened
6 months ago
6
Compare CMake and old Makefile features
#299
HomesGH
opened
6 months ago
0
Fix shifted parameter in SpinodalDecomp
#298
HomesGH
closed
6 months ago
0
Using `std::reduce` causes intel compiler to not work
#297
amartyads
closed
6 months ago
6
Langevin thermostat
#296
Snapex2409
opened
7 months ago
1
Update README.md
#295
HomesGH
closed
4 months ago
0
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