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21293f1c08
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update links and hashes for new plumed2 releases
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2023-03-13 12:10:41 -04:00 |
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401b5cee6d
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add -y flag to add-repository commands to avoid issues with GPG support changes
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2022-11-07 07:32:08 -05:00 |
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7aea2b8840
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update Plumed download to version 2.8.1
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2022-10-22 22:57:53 -04:00 |
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c235cbee71
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sync with lammps-testing and update plumed version consistently.
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2022-09-11 01:07:22 -04:00 |
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7769a8e0de
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update ROCm to version 5.1.3 consistently
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2022-06-08 12:18:17 -04:00 |
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44f3ad5620
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update singularity image descriptions for newer versions of cuda and rocm
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2022-05-15 08:11:50 -04:00 |
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b7a3af7bd1
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update plumed version in containers and install python3-venv
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2022-04-21 12:01:49 -04:00 |
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59e2b819e0
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need python3-venv package for updated make install-python
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2022-02-25 08:44:15 -05:00 |
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c03cdfdf60
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Add libyaml-cpp dev package
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2021-12-01 14:00:08 -05:00 |
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e75312ddf6
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Update ROCm containers to v4.5.0
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2021-12-01 13:24:07 -05:00 |
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ff919af3ef
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Update container bundled PLUMED to v2.7.3
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2021-12-01 11:39:05 -05:00 |
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d5f70ed347
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Update container definitions to include PLUMED 2.7.2
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2021-09-08 17:43:12 -04:00 |
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b74a32c1e3
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Update Singularity definitions to use ROCm 4.3
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2021-09-08 16:07:54 -04:00 |
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160f2cc630
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Update ROCm container definitions
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2021-04-02 16:11:23 -04:00 |
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865b159d16
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update singularity definitions for readline 6/7 to have a pkg-config file
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2020-10-14 15:06:57 -04:00 |
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4520eef1b0
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include readline support to be ready for LAMMPS-Shell
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2020-10-03 22:05:52 -04:00 |
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f6abdf97c4
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Remove -j in distribution container files
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2020-09-04 14:28:03 -04:00 |
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41a1c96e06
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Update other GPU containers
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2020-09-04 14:19:41 -04:00 |
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f9a202288c
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Add missing kmod package to AMD ROCm container
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2020-06-26 13:09:16 -04:00 |
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e6b3611c2d
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Update ROCm container to version 3.5
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2020-06-25 19:05:28 -04:00 |
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e006286603
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rather than forcing tcp communication for OpenMPI, we disable infiniband instead for better stability of tests
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2020-06-13 01:40:53 -04:00 |
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5827f69da5
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OpenMPI's "sm" transport layer has gone from some newer versions. use "tcp" as lowest common denominator
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2020-05-19 20:25:53 -04:00 |
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eefeaf4d25
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make OpenMPI only use shared memory comm by default and silence some warnings
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2020-05-07 18:15:57 -04:00 |
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4dce25d89e
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update some defitions files and also include hack to indicate image type in prompt
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2020-05-06 15:07:02 -04:00 |
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633651fa56
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Add valgrind, gdb to containers and clean caches
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2020-04-29 17:32:19 -04:00 |
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7b79b31018
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remove latex support from accelerator image definitions
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2020-04-27 15:17:45 -04:00 |
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9f923c51f8
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update singularity definition files for ubuntu variants to enable more LAMMPS build options and features
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2020-04-21 12:07:34 -04:00 |
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98fcf83180
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Checkout specific hipCUB version
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2020-04-10 15:31:06 -04:00 |
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c8481e620d
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set C locale
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2020-04-02 19:41:00 -04:00 |
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03988a9048
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Add ROCm Singularity container
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2020-04-01 17:29:07 -04:00 |
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