Commit Graph

1985 Commits

Author SHA1 Message Date
e6af365f8d New Proteus module
Proteus v1.4.0 as the first version in PModules
Directly dependency with ROOT software. Required also Eigen (Pmodule) when
compiling, Doxygen (PModule) and Sphinx (python-sphinx as local package)
for building the documentation.
2022-06-14 13:25:36 +02:00
f1fc39a866 Merge branch 'orca' into 'master'
Add ORCA 5.0.3

See merge request Pmodules/buildblocks!326
2022-06-09 14:46:57 +00:00
7976b44db8 Add ORCA 5.0.3 2022-06-09 16:46:24 +02:00
d4fddd3c1e Add ORCA 5.0.3 2022-06-09 16:40:25 +02:00
bbe44f711a Merge branch 'cuda_update' into 'master'
Update LIBRARY_PATH,C_INCLUDE_PATH,CPLUS_INCLUDE_PATH

See merge request Pmodules/buildblocks!323
2022-06-08 12:57:13 +00:00
f154bc2757 Update LIBRARY_PATH,C_INCLUDE_PATH,CPLUS_INCLUDE_PATH 2022-06-08 14:56:09 +02:00
cc6d5c8c26 Merge branch 'libnvidia-ml' into 'master'
Fix libnvidia-ml

See merge request Pmodules/buildblocks!319
2022-05-23 14:39:26 +00:00
16dc7b3165 Fix libnvidia-ml 2022-05-23 16:37:32 +02:00
8cf1a0c778 Merge branch 'hdf5_netcdf' into 'master'
HDF5+NetCDF with openmpi 4.1.3

See merge request Pmodules/buildblocks!313
2022-05-05 15:08:03 +00:00
a7bc0c8599 remove pnetcdf 1.10.0 2022-05-05 17:07:30 +02:00
e26c71b8b1 HDF5+NetCDF with openmpi 4.1.3 2022-05-05 17:05:13 +02:00
b83016d5ea Merge branch 'gsell-master-patch-49803' into 'master'
Update README.md

See merge request Pmodules/buildblocks!312
2022-05-02 11:59:56 +00:00
ae522d5556 Update README.md 2022-05-02 11:59:43 +00:00
c8d35e596d Merge branch 'gsell-master-patch-80997' into 'master'
Update README.md

See merge request Pmodules/buildblocks!311
2022-04-29 08:30:07 +00:00
db000e35d7 Update README.md 2022-04-29 08:29:42 +00:00
37a142722e Merge branch 'openmpi_4.1.3_cuda_11.5' into 'master'
UCX, CUDA and OpenMPI update

See merge request Pmodules/buildblocks!310
2022-04-05 14:47:26 +00:00
26d70ed734 OpenMPI: v4.0.7 to stable; new v4.1.3
Moved v4.0.7 releases from `unstable` to `stable`
Added new v4.1.3 with CUDA v1.5.1 and UCX v1.12.1
2022-04-05 11:39:50 +02:00
821f8c1faa UCX: moving to stable and add v1.12.1
Move `unstable` releases to `stable`
Add new v1.12.1 with CUDA v11.5.1
2022-04-05 11:19:53 +02:00
0fc8a2ecaf Move cuda 11.4.3,11.5.1 to stable 2022-04-05 11:17:10 +02:00
0217c446b3 Merge branch 'ucx_1.11_cuda_11.1' into 'master'
Add ucx/1.11.2-3_slurm with cuda/11.1.0

See merge request Pmodules/buildblocks!305
2022-03-29 10:00:40 +00:00
d88656c94e Add ucx/1.11.2-3_slurm with cuda/11.1.0 2022-03-29 12:00:03 +02:00
816041cf44 Merge branch 'gsell-master-patch-24720' into 'master'
Update README.md

See merge request Pmodules/buildblocks!303
2022-03-09 15:48:14 +00:00
8a23e552ee Update README.md 2022-03-09 15:47:59 +00:00
c1d243d795 Merge branch 'cryolo' into 'master'
Deprecating crYOLO/1.2.3 and moving other versions to stable

See merge request Pmodules/buildblocks!299
2022-02-16 15:46:42 +00:00
0fa181b856 Deprecating crYOLO/1.2.3 and moving other versions to stable
1.2.3 was based on miniconda and should be removed in the future
2022-02-16 16:45:06 +01:00
d46d0e643a Merge branch 'modelcraft' into 'master'
New module: modelcraft

See merge request Pmodules/buildblocks!298
2022-02-16 15:40:20 +00:00
4518dc2dd0 Merge branch 'anaconda' into 'master'
Mark psi-python as conflicting with anaconda.

See merge request Pmodules/buildblocks!295
2022-02-16 15:39:47 +00:00
Spencer Bliven
692881899e New module: modelcraft/2.2.3 2022-02-16 16:38:17 +01:00
cd5030439b Merge branch 'ansysupdate' into 'master'
Update ansys

See merge request Pmodules/buildblocks!297
2022-02-11 16:03:44 +00:00
510f7f50ac Update ansys 2022-02-11 17:02:31 +01:00
17b1f6b2ef Merge branch 'ansys' into 'master'
Ansys

See merge request Pmodules/buildblocks!296
2022-02-11 15:43:08 +00:00
Caubet Serrabou Marc
5e3909c06b Merge branch 'ansys' of https://gitlab.psi.ch/Pmodules/buildblocks into ansys 2022-02-11 16:40:14 +01:00
Caubet Serrabou Marc
8cabc31e61 Added ANSYS/2022R1 in merlin overlays 2022-02-11 16:39:34 +01:00
Caubet Serrabou Marc
ec623f6e6f Added ANSYS/2022R1 in merlin overlays 2022-02-11 12:37:04 +01:00
Caubet Serrabou Marc
22dbc179d0 Added ANSYS overlays 2022-02-11 12:36:15 +01:00
0b44a874eb ANSYS with overlays 2022-02-11 12:36:15 +01:00
Spencer Bliven
85386ace59 Mark psi-python as conflicting with anaconda.
These changes have already been applied by hand.
2022-01-25 18:04:57 +01:00
40041cccf3 Merge branch 'openmpi_4.0.5_cuda_10.4' into 'master'
Restore: Libraries UCX 1.11.2_slurm, which was deleted by mistake

See merge request Pmodules/buildblocks!294
2022-01-25 14:48:14 +00:00
dde68bb054 Restore: Libraries UCX 1.11.2_slurm, which was deleted by mistake 2022-01-25 15:47:19 +01:00
7839ca1d88 Merge branch 'openmpi_4.0.5_cuda_10.4' into 'master'
Openmpi 4.0.5 cuda 10.4

See merge request Pmodules/buildblocks!293
2022-01-25 14:45:42 +00:00
4ca1623d7e Add: OpenMPI 4.0.7_slurm 4.0.7-1_slurm 2022-01-25 15:43:45 +01:00
eab2aae1d7 Add: cuda/11.4.3, cuda/11.5.1 - unstable 2022-01-19 10:55:31 +01:00
6f47258f55 Merge branch 'caubet_m-master-patch-50743' into 'master'
Update README.md

See merge request Pmodules/buildblocks!292
2022-01-19 08:57:07 +00:00
803cf3114a Update README.md 2022-01-19 08:56:53 +00:00
38e55bb775 Merge branch 'alphafold' into 'master'
Alphafold/2.1.1 with multimer support!

See merge request Pmodules/buildblocks!291
2022-01-17 16:19:50 +00:00
9859bcb6f0 Alphafold/2.1.1 with multimer support! 2022-01-17 16:19:49 +00:00
dabcf08acd ANSYS with overlays 2021-12-08 17:29:37 +01:00
5f5f0c3d22 Merge branch 'openmpi_411' into 'master'
OpenMPI 4.1.1 with UCX 1.10

See merge request Pmodules/buildblocks!289
2021-12-08 16:00:45 +00:00
eaa93e0e24 OpenMPI 4.1.1 with UCX 1.10 2021-12-08 16:59:58 +01:00
8e80c89f3c Merge branch 'openmpi_411' into 'master'
Add OpenMPI 4.1.1 (gcc-10.2.0,ucx-1.11.2,cuda-11.3.0)

See merge request Pmodules/buildblocks!288
2021-12-08 13:22:29 +00:00