Skip to content
Merged
Show file tree
Hide file tree
Changes from all commits
Commits
File filter

Filter by extension

Filter by extension


Conversations
Failed to load comments.
Loading
Jump to
Jump to file
Failed to load files.
Loading
Diff view
Diff view
2 changes: 1 addition & 1 deletion .ci_support/environment-mpich.yml
Original file line number Diff line number Diff line change
Expand Up @@ -6,6 +6,6 @@ dependencies:
- mpich =4.2.2
- numpy =1.26.4
- mpi4py =4.0.0
- executorlib =0.0.2
- executorlib =0.0.3
- ase =3.23.0
- scipy =1.14.1
2 changes: 1 addition & 1 deletion .ci_support/environment-old.yml
Original file line number Diff line number Diff line change
Expand Up @@ -5,6 +5,6 @@ dependencies:
- openmpi
- numpy =1.23.5
- mpi4py =3.1.4
- executorlib =0.0.1
- executorlib =0.0.3
- ase =3.23.0
- scipy =1.9.3
2 changes: 1 addition & 1 deletion .ci_support/environment-openmpi.yml
Original file line number Diff line number Diff line change
Expand Up @@ -6,6 +6,6 @@ dependencies:
- openmpi =5.0.5
- numpy =1.26.4
- mpi4py =4.0.0
- executorlib =0.0.2
- executorlib =0.0.3
- ase =3.23.0
- scipy =1.14.1
2 changes: 1 addition & 1 deletion binder/environment.yml
Original file line number Diff line number Diff line change
Expand Up @@ -5,6 +5,6 @@ dependencies:
- numpy =1.26.4
- lammps =2024.06.27
- mpi4py =4.0.0
- executorlib =0.0.2
- executorlib =0.0.3
- ase =3.23.0
- scipy =1.14.1
6 changes: 3 additions & 3 deletions pylammpsmpi/wrapper/concurrent.py
Original file line number Diff line number Diff line change
Expand Up @@ -9,7 +9,7 @@
from typing import Any, List, Optional

from executorlib.shared import (
MpiExecInterface,
MpiExecSpawner,
RaisingThread,
cancel_items_in_queue,
interface_bootup,
Expand Down Expand Up @@ -55,10 +55,10 @@ def execute_async(
cmds.extend(cmdargs)
interface = interface_bootup(
command_lst=cmds,
connections=MpiExecInterface(
connections=MpiExecSpawner(
cwd=cwd,
cores=cores,
oversubscribe=oversubscribe,
openmpi_oversubscribe=oversubscribe,
),
)
while True:
Expand Down
2 changes: 1 addition & 1 deletion pyproject.toml
Original file line number Diff line number Diff line change
Expand Up @@ -25,7 +25,7 @@ classifiers = [
]
dependencies = [
"mpi4py==4.0.0",
"executorlib==0.0.2",
"executorlib==0.0.3",
"numpy==1.26.4",
]
dynamic = ["version"]
Expand Down
Loading