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nomad-lab
nomad-FAIR
Commits
e42f03ae
Commit
e42f03ae
authored
Jul 04, 2020
by
Lauri Himanen
Browse files
Merged.
parents
17541e25
e893fbff
Pipeline
#77853
passed with stages
in 28 minutes and 43 seconds
Changes
50
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1
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.gitlab-ci.yml
View file @
e42f03ae
...
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@@ -112,6 +112,14 @@ install_tests:
-
pip install `echo dist/nomad-lab-*.tar.gz`[parsing]
-
python -m nomad.cli parse tests/data/parsers/vasp/vasp.xml
dev_setup_tests
:
stage
:
test
image
:
python:3.7
script
:
-
pip install --upgrade pip
-
./setup.sh
-
python -m nomad.cli parse tests/data/parsers/vasp/vasp.xml
deploy
:
stage
:
deploy
before_script
:
...
...
.gitmodules
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e42f03ae
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@@ -194,3 +194,6 @@
[submodule "dependencies/encyclopedia-gui"]
path = dependencies/encyclopedia-gui
url = https://gitlab.mpcdf.mpg.de/nomad-lab/encyclopedia-gui.git
[submodule "dependencies/nomad-dos-fingerprints"]
path = dependencies/nomad-dos-fingerprints
url = https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-dos-fingerprints.git
LICENSE
.txt
→
LICENSE
View file @
e42f03ae
File moved
README.md
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e42f03ae
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@@ -26,12 +26,12 @@ You can install the `nomad` Python package from source distribution with pip. Pl
note, that this will only install part of NOMAD's dependencies that will only allow
your to use NOMAD's client library, e.g. to access the NOMAD Archive.
```
pip install nomad
--extra-index-url https://repository.nomad-coe.eu/v0.8/dist
pip install nomad
-lab
```
To
**use the NOMAD parsers for example**
, install the
`parsing`
extra:
```
pip install nomad[parsing]
--extra-index-url https://repository.nomad-coe.eu/v0.8/dist
pip install nomad
-lab
[parsing]
nomad parse --show-backend <your-file-to-parse>
```
...
...
@@ -48,6 +48,7 @@ Omitted versions are plain bugfix releases with only minor changes and fixes.
### v0.8.1
-
switched to support Python 3.7
-
client library as pypi package
`nomad-lab`
### v0.8.0
-
new underlying datamodel that allows to maintain multiple domains
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dependencies-git.sh
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e42f03ae
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@@ -15,7 +15,9 @@ git config -f .gitmodules --get-regexp '^submodule\..*\.path$' |
echo
"
$path
is not clean"
git stash
git checkout nomad-fair-metainfo
git stash apply
&&
git add
-A
&&
git commit
-a
-m
"
$1
"
git stash apply
git add
-A
git commit
-a
-m
"
$1
"
git push origin nomad-fair-metainfo
fi
done
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