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{chem}[intel/2015a] LAMMPS (WIP) #1559

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@boegel boegel commented Apr 21, 2015

soft matter (biomolecules, polymers) and coarse-grained or mesoscopic systems. It can be used to model atoms or,
more generically, as a parallel particle simulator at the atomic, meso, or continuum scale."""

toolchain = {'name': 'goolf', 'version': '1.5.14-no-OFED'}
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note: this is pretty wrong...

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Test FAILed.

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Test FAILed.

ocaisa and others added 4 commits April 24, 2015 10:08
Hacked to put the exe in the right place and explicitly list packages
Update LAMMPS-20150210-intel-2015a.eb

checksums = ['25a432713a3ad4969fdaaa2551d517ef']

patches = ['meam.patch']
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@ocaisa: can you provide me this patch file before I pick up on this again?

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Done

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ocaisa and others added 2 commits April 24, 2015 10:34
Fix outdated libs
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Test FAILed.

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ocaisa commented Sep 10, 2015

Tests fail because easyblock is not yet merged

@boegel boegel added this to the v2.4.0 milestone Sep 16, 2015
@boegel boegel modified the milestones: v2.4.0, v2.5.0 Nov 9, 2015
@boegel boegel modified the milestones: v2.5.0, v2.6.0 Dec 14, 2015
@boegel boegel modified the milestones: v2.6.0, v2.7.0 Jan 23, 2016
@boegel boegel modified the milestones: v2.8.0, v2.7.0 Mar 11, 2016
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Travis test report: 7/7 runs failed - see https://travis-ci.org/easybuilders/easybuild-easyconfigs/builds/367138503

Only showing partial log for 1st failed test suite run 8838.1;
full log at https://travis-ci.org/easybuilders/easybuild-easyconfigs/jobs/367138505

...
ERROR: Test for parsing of easyconfig LAMMPS-20150210-intel-2015a.eb
----------------------------------------------------------------------
Traceback (most recent call last):
  File "<string>", line 1, in innertest
  File "/home/travis/build/easybuilders/easybuild-easyconfigs/test/easyconfigs/easyconfigs.py", line 297, in template_easyconfig_test
    ecs = process_easyconfig(spec)
  File "/home/travis/virtualenv/python2.6.9/lib/python2.6/site-packages/easybuild_framework-3.6.0.dev0-py2.6.egg/easybuild/framework/easyconfig/easyconfig.py", line 1263, in process_easyconfig
    raise EasyBuildError("Failed to process easyconfig %s: %s", spec, err.msg)
EasyBuildError: "Failed to process easyconfig /home/travis/build/easybuilders/easybuild-easyconfigs/easybuild/easyconfigs/l/LAMMPS/LAMMPS-20150210-intel-2015a.eb: No software-specific easyblock 'EB_LAMMPS' found for LAMMPS"

======================================================================
FAIL: Check the easyconfigs for style
----------------------------------------------------------------------
Traceback (most recent call last):
  File "/home/travis/build/easybuilders/easybuild-easyconfigs/test/easyconfigs/styletests.py", line 61, in test_style_conformance
    self.assertEqual(result, 0, "Found code style errors (and/or warnings): %s" % result)
AssertionError: Found code style errors (and/or warnings): 14

----------------------------------------------------------------------
Ran 8750 tests in 241.738s

FAILED (failures=1, errors=1)
ERROR: Not all tests were successful.

(bleep, bloop, I'm just a bot, please talk to my owner @boegel if you notice you me acting stupid)

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@boegel, this PR is being closed for the following reason(s): obsoleted by more recent PRs.
Please don't hesitate to reopen this PR or add a comment if you feel this contribution is still relevant.
For more information on our policy w.r.t. closing PRs, see https://easybuild.readthedocs.io/en/latest/Contributing.html#why-a-pull-request-may-be-closed-by-a-maintainer

@boegel boegel deleted the LAMMPS branch June 22, 2020 08:50
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5 participants