- 18 Dec, 2013 1 commit
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Kenneth Hoste authored
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- 17 Dec, 2013 10 commits
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Kenneth Hoste authored
added vsc-base and vsc-mympirun
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Kenneth Hoste authored
Add support for CHARMM
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Ward Poelmans authored
We now use a string instead of list.
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Ward Poelmans authored
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Jens Timmerman authored
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Ward Poelmans authored
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Kenneth Hoste authored
add new elements for goolfc/2.0.10
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Fotis Georgatos authored
Signed-off-by: Fotis Georgatos <fotis.georgatos@uni.lu>
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Fotis Georgatos authored
Signed-off-by: Fotis Georgatos <fotis.georgatos@uni.lu>
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Fotis Georgatos authored
Signed-off-by: Fotis Georgatos <fotis.georgatos@uni.lu>
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- 16 Dec, 2013 4 commits
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Fotis Georgatos authored
Signed-off-by: Fotis Georgatos <fotis.georgatos@uni.lu>
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Fotis Georgatos authored
rework goolfc/2.6.10 easyconfigs using gcccuda subtoolchain, add GROMACS easyconfig for goolfc/2.6.10
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Kenneth Hoste authored
rework goolfc/2.6.10 easyconfigs using gcccuda subtoolchain, add GROMACS easyconfig for goolfc/2.6.10
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Kenneth Hoste authored
Config files for nano course
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- 13 Dec, 2013 1 commit
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Toon Verstraelen authored
Thanks for the fixes. Looks good!
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- 12 Dec, 2013 3 commits
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Kenneth Hoste authored
add easyconfigs for recent icc, ifort, impi and imkl versions
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Kenneth Hoste authored
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Ward Poelmans authored
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- 11 Dec, 2013 9 commits
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Kenneth Hoste authored
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Kenneth Hoste authored
Conflicts: easybuild/easyconfigs/i/imkl/imkl-10.2.6.038-32bit.eb
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Kenneth Hoste authored
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Kenneth Hoste authored
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Kenneth Hoste authored
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Kenneth Hoste authored
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Kenneth Hoste authored
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Kenneth Hoste authored
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Kenneth Hoste authored
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- 05 Dec, 2013 4 commits
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Toon Verstraelen authored
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Kenneth Hoste authored
add easyconfigs and patch for SAMtools 0.1.19
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Kenneth Hoste authored
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Kenneth Hoste authored
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- 04 Dec, 2013 1 commit
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Ward Poelmans authored
CHARMM (Chemistry at HARvard Macromolecular Mechanics) is a versatile and widely used molecular simulation program with broad application to many-particle systems. This is a non free program. You need to buy a license to obtain the source code.
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- 30 Nov, 2013 4 commits
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Kenneth Hoste authored
add easyconfigs for Parallel Python (PP)
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Kenneth Hoste authored
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Kenneth Hoste authored
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Toon Verstraelen authored
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- 29 Nov, 2013 3 commits
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pescobar authored
this depends on modified samtools.py easyblock
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Toon Verstraelen authored
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Toon Verstraelen authored
Several existing configs were copied and modified for the combination ictce-4.1.13 and Python-2.7.3. The OpenBabel package contains a Python extension, so they should get a Python-2.7.X suffix. A Config for molden was added.
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