Caubet Serrabou Marc 278d04929a Added Gromacs 2019 with GPU support

2019-08-20 14:09:53 +02:00

.gitlab/issue_templates

Delete New version.md

2019-08-16 15:02:18 +02:00

bin

update_releases

2018-05-15 12:58:51 +02:00

Compiler

openmpi/3.1.4 for gcc/8.3.0

2019-06-25 10:50:12 +02:00

EM/crYOLO

Create crYOLO module

2019-03-12 15:39:34 +01:00

HDF5

HDF5/trilinos: new versions and variants added

2019-01-17 12:17:59 +01:00

HDF5_serial

HDF5_blosc: variant with use-flag '_AVX2' added

2019-07-12 11:50:17 +02:00

Libraries

libungif: fixes

2019-07-12 11:59:22 +02:00

MPI

Added Gromacs 2019 with GPU support

2019-08-20 14:09:53 +02:00

MX

MX/DIALS: prefix specification fixed in install function

2019-01-21 17:12:52 +01:00

Programming

added environments for jupyterhub and tensorflow

2019-08-05 11:44:09 +02:00

System

version 7.80 added, fix in build-script

2019-08-16 15:30:37 +02:00

Tools

Merged changes

2019-05-27 13:59:42 +02:00

.gitattributes

lammps/files/lammps-2018.3.tar.gz added

2018-07-02 13:07:39 +02:00

.gitignore

.gitignore: Downloads dir added

2015-02-27 16:41:17 +01:00

Description

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222 MiB

Languages

Shell 52.1%

Python 47.9%