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Merge pull request #782 from hpcugentbot/auto_update_modules_2024-11-…
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Auto Update Modules [15 November 2024, 15:43]
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@boegel
boegel authored Nov 15, 2024
2 parents ed2a1dd + 8cdaee3 commit 76a8634
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/data/json_data.json
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/data/json_data_detail.json
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/BindCraft.md
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Expand Up @@ -21,4 +21,4 @@ module load BindCraft/1.1.0-foss-2023a

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|BindCraft/1.1.0-foss-2023a|x|x|x|x|-|x|x|
|BindCraft/1.1.0-foss-2023a|x|x|x|x|x|x|x|
2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/Flax.md
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Expand Up @@ -22,4 +22,4 @@ module load Flax/0.8.4-gfbf-2023a-CUDA-12.1.1
| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|Flax/0.8.4-gfbf-2023a-CUDA-12.1.1|x|-|x|-|x|-|-|
|Flax/0.8.4-gfbf-2023a|x|x|x|x|-|x|x|
|Flax/0.8.4-gfbf-2023a|x|x|x|x|x|x|x|
3 changes: 2 additions & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/GROMACS.md
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Expand Up @@ -14,13 +14,14 @@ The overview below shows which GROMACS installations are available per HPC-UGent
To start using GROMACS, load one of these modules using a `module load` command like:

```shell
module load GROMACS/2024.4-foss-2023b-CUDA-12.4.0
module load GROMACS/2024.4-foss-2023b-CUDA-12.4.0-PLUMED-2.9.2
```

*(This data was automatically generated on {{modules_last_updated}})*

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|GROMACS/2024.4-foss-2023b-CUDA-12.4.0-PLUMED-2.9.2|-|-|-|-|x|-|-|
|GROMACS/2024.4-foss-2023b-CUDA-12.4.0|-|-|-|-|x|-|-|
|GROMACS/2024.3-foss-2023b-PLUMED-2.9.2|-|-|-|-|-|x|x|
|GROMACS/2024.3-foss-2023b-CUDA-12.4.0|-|-|-|-|x|-|-|
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/Optax.md
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Expand Up @@ -22,5 +22,5 @@ module load Optax/0.2.2-gfbf-2023a-CUDA-12.1.1
| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|Optax/0.2.2-gfbf-2023a-CUDA-12.1.1|x|-|x|-|x|-|-|
|Optax/0.2.2-gfbf-2023a|x|x|x|x|-|x|x|
|Optax/0.2.2-gfbf-2023a|x|x|x|x|x|x|x|
|Optax/0.2.2-foss-2023a|x|x|x|x|-|x|-|
2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/PLUMED.md
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Expand Up @@ -21,7 +21,7 @@ module load PLUMED/2.9.2-foss-2023b

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|PLUMED/2.9.2-foss-2023b|x|x|x|x|-|x|x|
|PLUMED/2.9.2-foss-2023b|x|x|x|x|x|x|x|
|PLUMED/2.9.0-foss-2023a|x|x|x|x|x|x|x|
|PLUMED/2.9.0-foss-2022b|x|x|x|x|-|-|-|
|PLUMED/2.8.1-foss-2022a|x|x|x|x|-|-|-|
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3 changes: 2 additions & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/Valgrind.md
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Expand Up @@ -14,13 +14,14 @@ The overview below shows which Valgrind installations are available per HPC-UGen
To start using Valgrind, load one of these modules using a `module load` command like:

```shell
module load Valgrind/3.20.0-gompi-2022a
module load Valgrind/3.23.0-gompi-2023b
```

*(This data was automatically generated on {{modules_last_updated}})*

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|Valgrind/3.23.0-gompi-2023b|x|x|x|x|x|x|x|
|Valgrind/3.20.0-gompi-2022a|x|x|x|-|-|-|-|
|Valgrind/3.19.0-gompi-2022a|x|x|x|-|-|-|-|
|Valgrind/3.18.1-iimpi-2021b|x|x|x|-|-|-|-|
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/dm-haiku.md
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Expand Up @@ -21,7 +21,7 @@ module load dm-haiku/0.0.13-foss-2023a

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|dm-haiku/0.0.13-foss-2023a|x|x|x|x|-|x|x|
|dm-haiku/0.0.13-foss-2023a|x|x|x|x|x|x|x|
|dm-haiku/0.0.12-foss-2023a-CUDA-12.1.1|x|-|x|-|x|-|-|
|dm-haiku/0.0.12-foss-2023a|x|x|x|x|-|x|x|
|dm-haiku/0.0.9-foss-2022a-CUDA-11.7.0|-|-|x|-|-|-|-|
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/dorado.md
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Expand Up @@ -21,7 +21,7 @@ module load dorado/0.8.0-foss-2023a-CUDA-12.1.1

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|dorado/0.8.0-foss-2023a-CUDA-12.1.1|-|-|-|-|x|-|-|
|dorado/0.8.0-foss-2023a-CUDA-12.1.1|x|-|-|-|x|-|-|
|dorado/0.7.3-foss-2023a-CUDA-12.1.1|x|-|x|-|x|-|-|
|dorado/0.7.0-foss-2023a-CUDA-12.1.1|x|-|x|-|-|-|-|
|dorado/0.6.1-foss-2023a-CUDA-12.1.1|x|-|x|-|x|-|-|
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/jax.md
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Expand Up @@ -22,7 +22,7 @@ module load jax/0.4.25-gfbf-2023a-CUDA-12.1.1
| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|jax/0.4.25-gfbf-2023a-CUDA-12.1.1|x|-|x|-|x|-|-|
|jax/0.4.25-gfbf-2023a|x|x|x|x|-|x|x|
|jax/0.4.25-gfbf-2023a|x|x|x|x|x|x|x|
|jax/0.4.25-foss-2023a|x|x|x|x|-|x|x|
|jax/0.3.25-foss-2022a-CUDA-11.7.0|x|-|x|-|-|-|-|
|jax/0.3.25-foss-2022a|x|x|x|x|-|x|-|
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2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/py3Dmol.md
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Expand Up @@ -21,5 +21,5 @@ module load py3Dmol/2.1.0-GCCcore-12.3.0

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|py3Dmol/2.1.0-GCCcore-12.3.0|x|x|x|x|-|x|x|
|py3Dmol/2.1.0-GCCcore-12.3.0|x|x|x|x|x|x|x|
|py3Dmol/2.0.1.post1-GCCcore-11.3.0|x|x|x|x|-|-|-|
2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/pyWannier90.md
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Expand Up @@ -21,6 +21,6 @@ module load pyWannier90/2024-01-28-foss-2023a

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|pyWannier90/2024-01-28-foss-2023a|x|-|x|-|x|-|x|
|pyWannier90/2024-01-28-foss-2023a|x|x|x|x|x|x|x|
|pyWannier90/2021-12-07-gomkl-2021a|x|x|x|x|-|-|-|
|pyWannier90/2021-12-07-foss-2021a|x|x|x|x|-|-|-|
2 changes: 1 addition & 1 deletion mkdocs/docs/HPC/only/gent/available_software/detail/xxd.md
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Expand Up @@ -21,7 +21,7 @@ module load xxd/9.1.0307-GCCcore-13.2.0

| |accelgor|doduo|donphan|gallade|joltik|shinx|skitty|
| :---: | :---: | :---: | :---: | :---: | :---: | :---: | :---: |
|xxd/9.1.0307-GCCcore-13.2.0|x|x|x|x|-|x|x|
|xxd/9.1.0307-GCCcore-13.2.0|x|x|x|x|x|x|x|
|xxd/9.0.2112-GCCcore-12.3.0|x|x|x|x|x|x|x|
|xxd/9.0.1696-GCCcore-12.2.0|x|x|x|x|-|-|-|
|xxd/8.2.4220-GCCcore-11.3.0|x|x|x|x|-|-|-|
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2 changes: 1 addition & 1 deletion mkdocs/extra/gent.yml
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Expand Up @@ -16,7 +16,7 @@ hpcname: hpcugent
loginnode: login.hpc.ugent.be
loginhost: gligar07.gastly.os
altloginhost: gligar08.gastly.os
modules_last_updated: Thu, 14 Nov 2024 at 15:44:37 CET # This line is automatically updated by scripts/available_modules/available_modules.py
modules_last_updated: Fri, 15 Nov 2024 at 15:44:37 CET # This line is automatically updated by scripts/available_modules/available_modules.py
# get these with ssh-keyscan gligar01.ugent.be > file
# ssh-keygen -l -f file
# ssh-keygen -l -f file -E md5
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