issues
search
pyiron
/
pylammpsmpi
Parallel Lammps Python interface - control a mpi4py parallel LAMMPS instance from a serial python process or a Jupyter notebook
https://pylammpsmpi.readthedocs.io
BSD 3-Clause "New" or "Revised" License
30
stars
4
forks
source link
issues
Newest
Newest
Most commented
Recently updated
Oldest
Least commented
Least recently updated
Add more tests for base
#168
jan-janssen
closed
11 months ago
0
Update numpy to 1.26.3
#167
jan-janssen
closed
11 months ago
0
Implement interactive_velocities_getter()
#166
jan-janssen
closed
11 months ago
0
RaisingThread not found
#165
samwaseda
closed
11 months ago
7
Update pympipool to 0.7.9
#164
jan-janssen
closed
1 year ago
0
Update readthedocs environment
#163
jan-janssen
closed
1 year ago
0
Test pip no-build-isolation option
#162
jan-janssen
closed
1 year ago
0
Switch to pyproject.toml
#161
jan-janssen
closed
1 year ago
0
Update black action
#160
jan-janssen
closed
1 year ago
0
Test lower limits of dependencies
#159
jan-janssen
closed
1 year ago
0
Bump scipy from 1.11.3 to 1.11.4
#158
dependabot[bot]
closed
1 year ago
1
Update pympipool to 0.7.5
#157
jan-janssen
closed
1 year ago
0
Use trusted publisher action
#156
jan-janssen
closed
1 year ago
0
Bump numpy from 1.26.0 to 1.26.2
#155
dependabot[bot]
closed
1 year ago
1
Bump pympipool from 0.7.2 to 0.7.3
#154
dependabot[bot]
closed
1 year ago
0
Bump pympipool from 0.7.1 to 0.7.2
#153
dependabot[bot]
closed
1 year ago
0
Update pympipool to 0.7.2
#152
jan-janssen
closed
1 year ago
1
Bump numpy from 1.26.0 to 1.26.1
#151
dependabot[bot]
closed
1 year ago
1
Bump mpi4py from 3.1.4 to 3.1.5
#150
dependabot[bot]
closed
1 year ago
2
Migration to Python 3.12
#149
jan-janssen
closed
7 months ago
1
Update Lammps to 2023.08.02
#148
jan-janssen
closed
1 year ago
0
Use Coveralls Github action
#147
jan-janssen
closed
1 year ago
2
Update pympipool to 0.7.1
#146
jan-janssen
closed
1 year ago
0
versioneer update to 0.29
#145
jan-janssen
closed
1 year ago
0
Bump scipy from 1.11.2 to 1.11.3
#144
dependabot[bot]
closed
1 year ago
0
Environment issues
#143
srmnitc
closed
1 year ago
3
New version 0.2.3 is not installed
#142
srmnitc
closed
1 year ago
2
Bump numpy from 1.23.5 to 1.26.0
#141
dependabot[bot]
closed
1 year ago
1
Bump scipy from 1.11.1 to 1.11.2
#139
dependabot[bot]
closed
1 year ago
0
Compatibility to the latest changes in pympipool
#138
jan-janssen
closed
1 year ago
0
Bump numpy from 1.23.5 to 1.25.2
#137
dependabot[bot]
closed
1 year ago
1
Bump pympipool from 0.6.1 to 0.6.2
#136
dependabot[bot]
closed
1 year ago
0
Numpy 1.24.3
#135
jan-janssen
closed
1 year ago
1
Bump pympipool from 0.6.0 to 0.6.1
#134
dependabot[bot]
closed
1 year ago
0
Bump scipy from 1.10.1 to 1.11.1
#133
dependabot[bot]
closed
1 year ago
0
Add CI timeout
#132
jan-janssen
closed
1 year ago
0
Use new pympipool interface
#131
jan-janssen
closed
1 year ago
0
Add SLURM backend
#130
jan-janssen
closed
1 year ago
0
Move the ASE compatible interface from pyiron_lammps to pylammpsmpi
#129
jan-janssen
closed
1 year ago
0
Bump numpy from 1.23.5 to 1.25.1
#128
dependabot[bot]
closed
1 year ago
2
Bump pympipool from 0.5.5 to 0.5.6
#127
dependabot[bot]
closed
1 year ago
0
Remove the need to call start_process() manually
#126
jan-janssen
closed
1 year ago
0
[documentation] New documentation for version 0.2.0
#125
jan-janssen
opened
1 year ago
1
Add Documentation
#124
jan-janssen
closed
1 year ago
0
Use RaisingThread from pympipool
#123
jan-janssen
closed
1 year ago
0
Bump pympipool from 0.5.2 to 0.5.4
#122
dependabot[bot]
closed
1 year ago
0
Fix pympipool import
#121
jan-janssen
closed
1 year ago
0
Depend only on pympipool not on pyzmq
#120
jan-janssen
closed
1 year ago
1
flux implementation - support communication over the network
#119
jan-janssen
closed
1 year ago
0
Add flux backend support in lammps wrapper
#118
jan-janssen
closed
1 year ago
0
Previous
Next