commit
bbc8a92382
2
Makefile
2
Makefile
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@ -41,6 +41,8 @@ _build_wx/wxPython.target:
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@$(INSIDE_VENV) echo "Building wxPython for your `python --version 2>&1` under Linux $(DISTRO_RELEASE)..."
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# Create a folder to build wx into
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@mkdir -p _build_wx
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@$(INSIDE_VENV) pip install attrdict sip
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# TODO: attrdict is no longer compatible with collections package. The build will fail
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# download the wheel or the source if it cannot find a wheel
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@$(INSIDE_VENV) cd _build_wx && pip download -f https://extras.wxpython.org/wxPython4/extras/linux/gtk3/$(DISTRO_RELEASE) wxPython
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# Build the source if a tar.gz was downloaded
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@ -19,8 +19,8 @@
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# along with this msspec. If not, see <http://www.gnu.org/licenses/>.
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#
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# Source file : src/msspec/utils.py
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# Last modified: Mon, 27 Sep 2021 17:49:48 +0200
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# Committed by : sylvain tricot <sylvain.tricot@univ-rennes1.fr>
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# Last modified: Thu, 06 Oct 2022 18:27:24 +0200
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# Committed by : Sylvain Tricot <sylvain.tricot@univ-rennes1.fr> 1665073644 +0200
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"""
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@ -464,7 +464,7 @@ def hemispherical_cluster(cluster, emitter_tag=0, emitter_plane=0, diameter=0,
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a = cell[:, 0].max() # a lattice parameter
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# the number of planes in the cluster
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p = np.alen(np.unique(np.round(cluster.get_positions()[:, 2], 4)))
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p = len(np.unique(np.round(cluster.get_positions()[:, 2], 4)))
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# the symbol of your emitter
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symbol = cluster[np.where(cluster.get_tags() == emitter_tag)[0][0]].symbol
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@ -569,7 +569,7 @@ def hemispherical_cluster(cluster, emitter_tag=0, emitter_plane=0, diameter=0,
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# an array of all unique remaining z
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all_z = np.sort(np.unique(np.round(cluster.get_positions()[:, 2], 4)))
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assert emitter_plane < np.alen(all_z), ("There are not enough existing "
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assert emitter_plane < len(all_z), ("There are not enough existing "
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"plans.")
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ze = all_z[- emitter_plane - 1] # the z-coordinate of the emitter
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Atoms.translate(cluster, [0, 0, -ze]) # put the emitter in (0,0,0)
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@ -17,39 +17,38 @@
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# along with this msspec. If not, see <http://www.gnu.org/licenses/>.
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#
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# Source file : src/msspec/version.py
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# Last modified: Mon, 27 Sep 2021 17:49:48 +0200
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# Committed by : sylvain tricot <sylvain.tricot@univ-rennes1.fr>
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# Last modified: Thu, 06 Oct 2022 18:27:24 +0200
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# Committed by : Sylvain Tricot <sylvain.tricot@univ-rennes1.fr> 1665073644 +0200
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import os
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from pkg_resources import DistributionNotFound
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from pkg_resources import get_distribution
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from pkg_resources import parse_version
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from importlib.metadata import version
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import subprocess
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# find the version number
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# 1- Try to read it from the git info
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# 2- If it fails, try to read it from the distribution file
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# 1- If it fails, try to read it from the distribution file
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# 2- Try to read it from the git info
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# 3- If it fails, try to read it from the VERSION file
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PKGNAME = 'msspec'
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try:
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from setuptools_scm import get_version
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v = get_version(root='../../', relative_to=__file__, version_scheme="post-release")
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v = parse_version(v)
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if v._version.post[-1] == 0:
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__version__ = v.base_version
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else:
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__version__ = v.public
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__version__ = version(PKGNAME)
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except Exception as err:
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try:
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__version__ = get_distribution(__name__.strip('.version')).version
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p = subprocess.run(["git", "describe"], capture_output=True, text=True)
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if p.stdout not in ("", None):
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__version__ = p.stdout.strip()
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else:
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raise NameError("git describe failed!")
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except Exception as err:
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try:
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thisfile_path = os.path.abspath(__file__)
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thisfile_dir = os.path.dirname(thisfile_path)
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versionfile = os.path.join(thisfile_dir, "../VERSION")
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with open(versionfile, "r") as fd:
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__version__ = fd.readline()
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__version__ = fd.readline().strip()
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except Exception as err:
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print("Unable to get the version number!")
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__version__ = "9.9.9"
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@ -41,8 +41,7 @@ F2PYFLAGS_DBG = --debug-capi --debug
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# /!\ DO NOT EDIT BELOW THAT LINE (unlesss you know what you're doing...) #
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# CORE CONFIGURATION #
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################################################################################
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#VERSION:=$(shell python -c "import msspec; print(msspec.__version__)")
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VERSION:=$(shell git describe|sed 's/-\([[:digit:]]\+\)-.*/\.post\1/')
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VERSION:=$(shell git describe)
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VENV_PATH := $(INSTALL_PREFIX)/src/msspec_venv_$(VERSION)
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