Expected behavior.
Hi everyone,
as requested, I’m starting a new thread with my problem, which I first described in this thread:
Expected behavior:
(1)
CADET should be able to reliably autodetect its own installation, when running
from CADETProcess.simulator import Cadet
process_simulator = Cadet()
in a Jupyter notebook…
(2)
If CADET autodetection and simulation works in a Jupyter notebook, the same model should work as a .py file?
Actual behavior
(1)
When working with CADET using a Jupyter notebook in VSCode, I regularly encounter
“FileNotFoundError: CADET could not be found. Please check the path.”
But I can always make the simulation work by a combination of saving and re-opening the notebook and VSCode, and activating my CADET environment in conda. The error seems to arise often, when I start working on a notebook with a CADET simulation, that is in another directory than the one I worked on before. But I can solve the problem very quickly. Here, I don’t need to specify a path for the simulator.
(2)
I recently created a .py file from my notebook, a simple chromatography simulation. Every time I try to run the simulation in VSCode from the .py file, without specifying a path for the simulator, I get the “FileNotFoundError: CADET could not be found. Please check the path.”. Here, activating the environment, and saving and re-opening the .py file doesn’t seem to help. I tried providing some paths when setting up the process simulator. For example, I tried to get the CADET installation path as follows in my Jupyter notebook (in one of those cases, where the simulation is working overall):
from CADETProcess.simulator import Cadet
process_simulator = Cadet()
print(process_simulator.install_path)
I get:
E:\Programme\Miniforge3\envs\cadet_workshop
I passed it to the process_simulator in my .py - file like this:
process_simulator = Cadet(‘E:\Programme\Miniforge3\envs\cadet_workshop’)
Now here is my complete Terminal output in VSCode, when trying to run this specific .py file. It contains an error message about conda, as well as the traceback of the CADET error:
PS E:\Projekte\Cadet-Simulation\eigener Code> conda activate cadet_workshop
conda : Die Benennung “conda” wurde nicht als Name eines Cmdlet, einer Funktion, einer Skriptdatei oder eines
ausführbaren Programms erkannt. Überprüfen Sie die Schreibweise des Namens, oder ob der Pfad korrekt ist (sofern
enthalten), und wiederholen Sie den Vorgang.
In Zeile:1 Zeichen:1
conda activate cadet_workshop
+ CategoryInfo : ObjectNotFound: (conda:String) [], CommandNotFoundException
+ FullyQualifiedErrorId : CommandNotFoundException
PS E:\Projekte\Cadet-Simulation\eigener Code> & E:/Programme/Miniforge3/envs/cadet_workshop/python.exe “e:/Projekte/Cadet-Simulation/eigener Code/LRMP_1_Komponente.py”
E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\PolyRound_init_.py:1: UserWarning: pkg_resources is
deprecated as an API. See Package Discovery and Resource Access using pkg_resources - setuptools 80.9.0 documentation . The pkg_resources package is slated for removal as early as 2025-11-30. Refrain from using this package or pin to Setuptools<81.
from pkg_resources import get_distribution, DistributionNotFound
There was an exception in simulate_n_cycles
Traceback (most recent call last):
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\runner.py”, line 202, in _get_cadet_version
result = subprocess.run(
^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\subprocess.py”, line 571, in run
raise CalledProcessError(retcode, process.args,
subprocess.CalledProcessError: Command ‘[WindowsPath(‘E:/Programme/Miniforge3/envs/cadet_workshop/bin/cadet-cli.exe’), ‘–version’]’ returned non-zero exit status 3221225781.
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\log.py”, line 192, in wrapper
return function(*args, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\simulator.py”, line 334, in simulate_n_cycles
return self._run(process, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\cadetAdapter.py”, line 154, in wrapper
results = func(self, process, *args, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\cadetAdapter.py”, line 260, in _run
cadet = self.get_new_cadet_instance()
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\cadetAdapter.py”, line 364, in get_new_cadet_instance
cadet = CadetAPI(install_path=self.install_path, use_dll=self.use_dll)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\cadet.py”, line 230, in init
self.install_path = install_path # This will automatically set the runners.
^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\cadet.py”, line 299, in install_path
self._cadet_cli_runner = CadetCLIRunner(cadet_cli_path)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\runner.py”, line 124, in init
self._get_cadet_version()
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\runner.py”, line 237, in _get_cadet_version
raise RuntimeError(f"Command execution failed: {e}")
RuntimeError: Command execution failed: Command ‘[WindowsPath(‘E:/Programme/Miniforge3/envs/cadet_workshop/bin/cadet-cli.exe’), ‘–version’]’ returned non-zero exit status 3221225781.
Traceback (most recent call last):
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\runner.py”, line 202, in _get_cadet_version
result = subprocess.run(
^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\subprocess.py”, line 571, in run
raise CalledProcessError(retcode, process.args,
subprocess.CalledProcessError: Command ‘[WindowsPath(‘E:/Programme/Miniforge3/envs/cadet_workshop/bin/cadet-cli.exe’), ‘–version’]’ returned non-zero exit status 3221225781.
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File “e:\Projekte\Cadet-Simulation\eigener Code\LRMP_1_Komponente.py”, line 207, in
simulation_results = process_simulator.simulate(process)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\simulator.py”, line 275, in simulate
results = self.simulate_n_cycles(
^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\log.py”, line 164, in wrapper
result = function(*args, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\log.py”, line 225, in wrapper
results = function(*args, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\log.py”, line 200, in wrapper
raise e
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\log.py”, line 192, in wrapper
return function(*args, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\simulator.py”, line 334, in simulate_n_cycles
return self._run(process, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\cadetAdapter.py”, line 154, in wrapper
results = func(self, process, *args, **kwargs)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\cadetAdapter.py”, line 260, in _run
cadet = self.get_new_cadet_instance()
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\CADETProcess\simulator\cadetAdapter.py”, line 364, in get_new_cadet_instance
cadet = CadetAPI(install_path=self.install_path, use_dll=self.use_dll)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\cadet.py”, line 230, in init
self.install_path = install_path # This will automatically set the runners.
^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\cadet.py”, line 299, in install_path
self._cadet_cli_runner = CadetCLIRunner(cadet_cli_path)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\runner.py”, line 124, in init
self._get_cadet_version()
File “E:\Programme\Miniforge3\envs\cadet_workshop\Lib\site-packages\cadet\runner.py”, line 237, in _get_cadet_version
raise RuntimeError(f"Command execution failed: {e}")
RuntimeError: Command execution failed: Command ‘[WindowsPath(‘E:/Programme/Miniforge3/envs/cadet_workshop/bin/cadet-cli.exe’), ‘–version’]’ returned non-zero exit status 3221225781.
PS E:\Projekte\Cadet-Simulation\eigener Code>
Apart from that, I tried setting the following paths for the simulator:
E:\Programme\Miniforge3\envs\cadet_workshop\bin
E:\Programme\Miniforge3\envs\cadet_workshop\bin\cadet-cli.exe
That also brought varying error messages that all seem to revolve around CADET not finding required files.
conda list gives the following output (sorry for the formatting, it turns out like this when I copy it from the console):
packages in environment at E:\Programme\Miniforge3\envs\cadet_workshop:
Name Version Build Channel
_openmp_mutex 4.5 2_gnu conda-forge
about-time 4.2.1 pypi_0 pypi
addict 2.3.0 pypi_0 pypi
alive-progress 3.2.0 pypi_0 pypi
anyio 4.9.0 pyh29332c3_0 conda-forge
argon2-cffi 25.1.0 pyhd8ed1ab_0 conda-forge
argon2-cffi-bindings 21.2.0 py311he736701_5 conda-forge
arrow 1.3.0 pyhd8ed1ab_1 conda-forge
arviz 0.21.0 pypi_0 pypi
asttokens 3.0.0 pyhd8ed1ab_1 conda-forge
async-lru 2.0.5 pyh29332c3_0 conda-forge
attrs 25.3.0 pyh71513ae_0 conda-forge
autograd 1.8.0 pypi_0 pypi
babel 2.17.0 pyhd8ed1ab_0 conda-forge
beautifulsoup4 4.13.4 pyha770c72_0 conda-forge
bleach 6.2.0 pyh29332c3_4 conda-forge
bleach-with-css 6.2.0 h82add2a_4 conda-forge
brotli-python 1.1.0 py311hda3d55a_3 conda-forge
bzip2 1.0.8 h2466b09_7 conda-forge
ca-certificates 2025.6.15 h4c7d964_0 conda-forge
cached-property 1.5.2 hd8ed1ab_1 conda-forge
cached_property 1.5.2 pyha770c72_1 conda-forge
cadet 5.0.4 h5e8923b_0 conda-forge
cadet-process 0.11.1 pypi_0 pypi
cadet-python 1.1.0 pypi_0 pypi
certifi 2025.6.15 pyhd8ed1ab_0 conda-forge
cffi 1.17.1 py311he736701_0 conda-forge
cfgv 3.3.1 pyhd8ed1ab_1 conda-forge
charset-normalizer 3.4.2 pyhd8ed1ab_0 conda-forge
cma 4.2.0 pypi_0 pypi
colorama 0.4.6 pyhd8ed1ab_1 conda-forge
comm 0.2.2 pyhd8ed1ab_1 conda-forge
contourpy 1.3.2 pypi_0 pypi
corner 2.2.3 pypi_0 pypi
cpython 3.11.13 py311hd8ed1ab_0 conda-forge
cycler 0.12.1 pypi_0 pypi
debugpy 1.8.14 py311hda3d55a_0 conda-forge
decorator 5.2.1 pyhd8ed1ab_0 conda-forge
defusedxml 0.7.1 pyhd8ed1ab_0 conda-forge
deprecated 1.2.18 pypi_0 pypi
dill 0.4.0 pypi_0 pypi
diskcache 5.6.3 pypi_0 pypi
distlib 0.3.9 pyhd8ed1ab_1 conda-forge
et-xmlfile 2.0.0 pypi_0 pypi
exceptiongroup 1.3.0 pyhd8ed1ab_0 conda-forge
executing 2.2.0 pyhd8ed1ab_0 conda-forge
filelock 3.18.0 pyhd8ed1ab_0 conda-forge
fonttools 4.58.4 pypi_0 pypi
fqdn 1.5.1 pyhd8ed1ab_1 conda-forge
gitdb 4.0.12 pyhd8ed1ab_0 conda-forge
gitpython 3.1.44 pyhff2d567_0 conda-forge
gmp 6.3.0 hfeafd45_2 conda-forge
grapheme 0.6.0 pypi_0 pypi
h11 0.16.0 pyhd8ed1ab_0 conda-forge
h2 4.2.0 pyhd8ed1ab_0 conda-forge
h5netcdf 1.6.1 pypi_0 pypi
h5py 3.14.0 pypi_0 pypi
hdf5 1.14.3 nompi_hb2c4d47_109 conda-forge
hopsy 1.6.1 pypi_0 pypi
hpack 4.1.0 pyhd8ed1ab_0 conda-forge
httpcore 1.0.9 pyh29332c3_0 conda-forge
httpx 0.28.1 pyhd8ed1ab_0 conda-forge
hyperframe 6.1.0 pyhd8ed1ab_0 conda-forge
identify 2.6.12 pyhd8ed1ab_0 conda-forge
idna 3.10 pyhd8ed1ab_1 conda-forge
importlib-metadata 8.7.0 pyhe01879c_1 conda-forge
importlib_resources 6.5.2 pyhd8ed1ab_0 conda-forge
intel-openmp 2024.2.1 h57928b3_1083 conda-forge
ipykernel 6.29.5 pyh4bbf305_0 conda-forge
ipympl 0.9.7 pypi_0 pypi
ipython 9.3.0 pyh6be1c34_0 conda-forge
ipython_pygments_lexers 1.1.1 pyhd8ed1ab_0 conda-forge
ipywidgets 8.1.7 pyhd8ed1ab_0 conda-forge
isoduration 20.11.0 pyhd8ed1ab_1 conda-forge
jedi 0.19.2 pyhd8ed1ab_1 conda-forge
jinja2 3.1.6 pyhd8ed1ab_0 conda-forge
joblib 1.5.1 pypi_0 pypi
json5 0.12.0 pyhd8ed1ab_0 conda-forge
jsonpointer 3.0.0 py311h1ea47a8_1 conda-forge
jsonschema 4.24.0 pyhd8ed1ab_0 conda-forge
jsonschema-specifications 2025.4.1 pyh29332c3_0 conda-forge
jsonschema-with-format-nongpl 4.24.0 hd8ed1ab_0 conda-forge
jupyter 1.1.1 pyhd8ed1ab_1 conda-forge
jupyter-lsp 2.2.5 pyhe01879c_2 conda-forge
jupyter_client 8.6.3 pyhd8ed1ab_1 conda-forge
jupyter_console 6.6.3 pyhd8ed1ab_1 conda-forge
jupyter_core 5.8.1 pyh5737063_0 conda-forge
jupyter_events 0.12.0 pyh29332c3_0 conda-forge
jupyter_server 2.16.0 pyhe01879c_0 conda-forge
jupyter_server_terminals 0.5.3 pyhd8ed1ab_1 conda-forge
jupyterlab 4.4.3 pyhd8ed1ab_0 conda-forge
jupyterlab-deck 0.2.0 pypi_0 pypi
jupyterlab-fonts 3.0.0 pypi_0 pypi
jupyterlab-myst 2.4.2 pypi_0 pypi
jupyterlab_pygments 0.3.0 pyhd8ed1ab_2 conda-forge
jupyterlab_server 2.27.3 pyhd8ed1ab_1 conda-forge
jupyterlab_widgets 3.0.15 pyhd8ed1ab_0 conda-forge
jupytext 1.17.2 pyh80e38bb_0 conda-forge
kiwisolver 1.4.8 pypi_0 pypi
krb5 1.21.3 hdf4eb48_0 conda-forge
libaec 1.1.4 h20038f6_0 conda-forge
libamd 3.3.3 h60129d2_7100102 conda-forge
libblas 3.9.0 32_h641d27c_mkl conda-forge
libbtf 2.3.2 h8c1c262_7100102 conda-forge
libcamd 3.3.3 h8c1c262_7100102 conda-forge
libcblas 3.9.0 32_h5e41251_mkl conda-forge
libccolamd 3.3.4 h8c1c262_7100102 conda-forge
libcholmod 5.3.1 hdf2ebef_7100102 conda-forge
libcolamd 3.3.4 h8c1c262_7100102 conda-forge
libcurl 8.14.1 h88aaa65_0 conda-forge
libcxsparse 4.4.1 h8c1c262_7100102 conda-forge
libexpat 2.7.0 he0c23c2_0 conda-forge
libffi 3.4.6 h537db12_1 conda-forge
libgcc 15.1.0 h1383e82_2 conda-forge
libgomp 15.1.0 h1383e82_2 conda-forge
libhwloc 2.11.2 default_ha69328c_1001 conda-forge
libiconv 1.18 h135ad9c_1 conda-forge
libklu 2.3.5 h77a2eaa_7100102 conda-forge
liblapack 3.9.0 32_h1aa476e_mkl conda-forge
libldl 3.3.2 h8c1c262_7100102 conda-forge
liblzma 5.8.1 h2466b09_2 conda-forge
libparu 1.0.0 hd80212b_7100102 conda-forge
librbio 4.3.4 h8c1c262_7100102 conda-forge
libsodium 1.0.20 hc70643c_0 conda-forge
libspex 3.2.3 h2f847cc_7100102 conda-forge
libspqr 4.3.4 h60c7c62_7100102 conda-forge
libsqlite 3.50.1 hf5d6505_6 conda-forge
libssh2 1.11.1 h9aa295b_0 conda-forge
libsuitesparseconfig 7.10.1 h0795de7_7100102 conda-forge
libumfpack 6.3.5 h4ca129d_7100102 conda-forge
libwinpthread 12.0.0.r4.gg4f2fc60ca h57928b3_9 conda-forge
libxml2 2.13.8 h442d1da_0 conda-forge
libzlib 1.3.1 h2466b09_2 conda-forge
llvmlite 0.44.0 pypi_0 pypi
markdown-it-py 3.0.0 pyhd8ed1ab_1 conda-forge
markupsafe 3.0.2 py311h5082efb_1 conda-forge
matplotlib 3.10.3 pypi_0 pypi
matplotlib-inline 0.1.7 pyhd8ed1ab_1 conda-forge
mdit-py-plugins 0.4.2 pyhd8ed1ab_1 conda-forge
mdurl 0.1.2 pyhd8ed1ab_1 conda-forge
metis 5.1.0 h17e2fc9_1007 conda-forge
mistune 3.1.3 pyh29332c3_0 conda-forge
mkl 2024.2.2 h66d3029_15 conda-forge
mpfr 4.2.1 hbc20e70_3 conda-forge
mpmath 1.3.0 pypi_0 pypi
multiprocess 0.70.18 pypi_0 pypi
nbclient 0.10.2 pyhd8ed1ab_0 conda-forge
nbconvert-core 7.16.6 pyh29332c3_0 conda-forge
nbformat 5.10.4 pyhd8ed1ab_1 conda-forge
nbtoolbelt 2024.7.2 pypi_0 pypi
nest-asyncio 1.6.0 pyhd8ed1ab_1 conda-forge
nodeenv 1.9.1 pyhd8ed1ab_1 conda-forge
notebook 7.4.3 pyhd8ed1ab_0 conda-forge
notebook-shim 0.2.4 pyhd8ed1ab_1 conda-forge
numba 0.61.2 pypi_0 pypi
numpy 1.26.4 pypi_0 pypi
openpyxl 3.1.5 pypi_0 pypi
openssl 3.5.0 ha4e3fda_1 conda-forge
optlang 1.8.3 pypi_0 pypi
overrides 7.7.0 pyhd8ed1ab_1 conda-forge
packaging 25.0 pyh29332c3_1 conda-forge
pandas 2.3.0 pypi_0 pypi
pandocfilters 1.5.0 pyhd8ed1ab_0 conda-forge
parso 0.8.4 pyhd8ed1ab_1 conda-forge
pathos 0.3.4 pypi_0 pypi
pickleshare 0.7.5 pyhd8ed1ab_1004 conda-forge
pillow 11.2.1 pypi_0 pypi
pip 25.1.1 pyh8b19718_0 conda-forge
pkgutil-resolve-name 1.3.10 pyhd8ed1ab_2 conda-forge
platformdirs 4.3.8 pyhe01879c_0 conda-forge
polyround 0.3.0 pypi_0 pypi
pox 0.3.6 pypi_0 pypi
ppft 1.7.7 pypi_0 pypi
pre-commit 4.2.0 pyha770c72_0 conda-forge
prometheus_client 0.22.1 pyhd8ed1ab_0 conda-forge
prompt-toolkit 3.0.51 pyha770c72_0 conda-forge
prompt_toolkit 3.0.51 hd8ed1ab_0 conda-forge
psutil 7.0.0 py311he736701_0 conda-forge
pure_eval 0.2.3 pyhd8ed1ab_1 conda-forge
pycparser 2.22 pyh29332c3_1 conda-forge
pygments 2.19.2 pyhd8ed1ab_0 conda-forge
pymoo 0.6.1.5 pypi_0 pypi
pyparsing 3.2.3 pypi_0 pypi
pysocks 1.7.1 pyh09c184e_7 conda-forge
python 3.11.13 h3f84c4b_0_cpython conda-forge
python-dateutil 2.9.0.post0 pyhff2d567_1 conda-forge
python-fastjsonschema 2.21.1 pyhd8ed1ab_0 conda-forge
python-json-logger 2.0.7 pyhd8ed1ab_0 conda-forge
python_abi 3.11 7_cp311 conda-forge
pytz 2025.2 pyhd8ed1ab_0 conda-forge
pywin32 307 py311hda3d55a_3 conda-forge
pywinpty 2.0.15 py311hda3d55a_0 conda-forge
pyyaml 6.0.2 py311h5082efb_2 conda-forge
pyzmq 27.0.0 py311h484c95c_0 conda-forge
referencing 0.36.2 pyh29332c3_0 conda-forge
requests 2.32.4 pyhd8ed1ab_0 conda-forge
rfc3339-validator 0.1.4 pyhd8ed1ab_1 conda-forge
rfc3986-validator 0.1.1 pyh9f0ad1d_0 conda-forge
rpds-py 0.25.1 py311hc4022dc_0 conda-forge
scikit-learn 1.7.0 pypi_0 pypi
scipy 1.16.0 pypi_0 pypi
send2trash 1.8.3 pyh5737063_1 conda-forge
setuptools 80.9.0 pyhff2d567_0 conda-forge
six 1.17.0 pyhd8ed1ab_0 conda-forge
smmap 5.0.2 pyhd8ed1ab_0 conda-forge
sniffio 1.3.1 pyhd8ed1ab_1 conda-forge
soupsieve 2.7 pyhd8ed1ab_0 conda-forge
stack_data 0.6.3 pyhd8ed1ab_1 conda-forge
suitesparse 7.10.1 hfa24a04_7100102 conda-forge
swiglpk 5.0.12 pypi_0 pypi
sympy 1.14.0 pypi_0 pypi
tbb 2021.13.0 h62715c5_1 conda-forge
tbb-devel 2021.13.0 h47441b3_1 conda-forge
terminado 0.18.1 pyh5737063_0 conda-forge
threadpoolctl 3.6.0 pypi_0 pypi
tinycss2 1.4.0 pyhd8ed1ab_0 conda-forge
tk 8.6.13 h2c6b04d_2 conda-forge
tomli 2.2.1 pyhd8ed1ab_1 conda-forge
tornado 6.5.1 py311he736701_0 conda-forge
tqdm 4.67.1 pypi_0 pypi
traitlets 5.14.3 pyhd8ed1ab_1 conda-forge
types-python-dateutil 2.9.0.20250516 pyhd8ed1ab_0 conda-forge
typing-extensions 4.14.0 h32cad80_0 conda-forge
typing_extensions 4.14.0 pyhe01879c_0 conda-forge
typing_utils 0.1.0 pyhd8ed1ab_1 conda-forge
tzdata 2025.2 pypi_0 pypi
ucrt 10.0.22621.0 h57928b3_1 conda-forge
ukkonen 1.0.1 py311h3257749_5 conda-forge
uri-template 1.3.0 pyhd8ed1ab_1 conda-forge
urllib3 2.5.0 pyhd8ed1ab_0 conda-forge
vc 14.3 h41ae7f8_26 conda-forge
vc14_runtime 14.44.35208 h818238b_26 conda-forge
virtualenv 20.31.2 pyhd8ed1ab_0 conda-forge
vs2015_runtime 14.44.35208 h38c0c73_26 conda-forge
wcwidth 0.2.13 pyhd8ed1ab_1 conda-forge
webcolors 24.11.1 pyhd8ed1ab_0 conda-forge
webencodings 0.5.1 pyhd8ed1ab_3 conda-forge
websocket-client 1.8.0 pyhd8ed1ab_1 conda-forge
wheel 0.45.1 pyhd8ed1ab_1 conda-forge
widgetsnbextension 4.0.14 pyhd8ed1ab_0 conda-forge
win_inet_pton 1.1.0 pyh7428d3b_8 conda-forge
winpty 0.4.3 4 conda-forge
wrapt 1.17.2 pypi_0 pypi
xarray 2025.6.1 pypi_0 pypi
xarray-einstats 0.9.1 pypi_0 pypi
yaml 0.2.5 h8ffe710_2 conda-forge
zeromq 4.3.5 ha9f60a1_7 conda-forge
zipp 3.23.0 pyhd8ed1ab_0 conda-forge
zstandard 0.23.0 py311he736701_2 conda-forge
pip freeze output:
about-time==4.2.1
addict==2.3.0
alive-progress==3.2.0
anyio @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_anyio_1742243108/work
argon2-cffi @ file:///home/conda/feedstock_root/build_artifacts/argon2-cffi_1749017159514/work
argon2-cffi-bindings @ file:///D:/bld/argon2-cffi-bindings_1725356669592/work
arrow @ file:///home/conda/feedstock_root/build_artifacts/arrow_1733584251875/work
arviz==0.21.0
asttokens @ file:///home/conda/feedstock_root/build_artifacts/asttokens_1733250440834/work
async-lru @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_async-lru_1742153708/work
attrs @ file:///home/conda/feedstock_root/build_artifacts/attrs_1741918516150/work
autograd==1.8.0
babel @ file:///home/conda/feedstock_root/build_artifacts/babel_1738490167835/work
beautifulsoup4 @ file:///home/conda/feedstock_root/build_artifacts/beautifulsoup4_1744783198182/work
bleach @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_bleach_1737382993/work
Brotli @ file:///D:/bld/brotli-split_1749229870877/work
cached-property @ file:///home/conda/feedstock_root/build_artifacts/cached_property_1615209429212/work
CADET-Process==0.11.1
CADET-Python==1.1.0
certifi @ file:///home/conda/feedstock_root/build_artifacts/certifi_1749972191589/work/certifi
cffi @ file:///D:/bld/cffi_1725560706917/work
cfgv @ file:///home/conda/feedstock_root/build_artifacts/cfgv_1734267080977/work
charset-normalizer @ file:///home/conda/feedstock_root/build_artifacts/charset-normalizer_1746214863626/work
cma==4.2.0
colorama @ file:///home/conda/feedstock_root/build_artifacts/colorama_1733218098505/work
comm @ file:///home/conda/feedstock_root/build_artifacts/comm_1733502965406/work
contourpy==1.3.2
corner==2.2.3
cycler==0.12.1
debugpy @ file:///D:/bld/debugpy_1744321277463/work
decorator @ file:///home/conda/feedstock_root/build_artifacts/decorator_1740384970518/work
defusedxml @ file:///home/conda/feedstock_root/build_artifacts/defusedxml_1615232257335/work
Deprecated==1.2.18
dill==0.4.0
diskcache==5.6.3
distlib @ file:///home/conda/feedstock_root/build_artifacts/distlib_1733238395481/work
et_xmlfile==2.0.0
exceptiongroup @ file:///home/conda/feedstock_root/build_artifacts/exceptiongroup_1746947292760/work
executing @ file:///home/conda/feedstock_root/build_artifacts/executing_1745502089858/work
fastjsonschema @ file:///home/conda/feedstock_root/build_artifacts/python-fastjsonschema_1733235979760/work/dist
filelock @ file:///home/conda/feedstock_root/build_artifacts/filelock_1741969488311/work
fonttools==4.58.4
fqdn @ file:///home/conda/feedstock_root/build_artifacts/fqdn_1733327382592/work/dist
gitdb @ file:///home/conda/feedstock_root/build_artifacts/gitdb_1735887193964/work
GitPython @ file:///home/conda/feedstock_root/build_artifacts/gitpython_1735929639977/work
grapheme==0.6.0
h11 @ file:///home/conda/feedstock_root/build_artifacts/h11_1745526374115/work
h2 @ file:///home/conda/feedstock_root/build_artifacts/h2_1738578511449/work
h5netcdf==1.6.1
h5py==3.14.0
hopsy==1.6.1
hpack @ file:///home/conda/feedstock_root/build_artifacts/hpack_1737618293087/work
httpcore @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_httpcore_1745602916/work
httpx @ file:///home/conda/feedstock_root/build_artifacts/httpx_1733663348460/work
hyperframe @ file:///home/conda/feedstock_root/build_artifacts/hyperframe_1737618333194/work
identify @ file:///home/conda/feedstock_root/build_artifacts/identify_1748049649574/work
idna @ file:///home/conda/feedstock_root/build_artifacts/idna_1733211830134/work
importlib_metadata @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_importlib-metadata_1747934053/work
importlib_resources @ file:///home/conda/feedstock_root/build_artifacts/importlib_resources_1736252299705/work
ipykernel @ file:///D:/bld/ipykernel_1719845595208/work
ipympl==0.9.7
ipython @ file:///D:/bld/bld/rattler-build_ipython_1748711232/work
ipython_pygments_lexers @ file:///home/conda/feedstock_root/build_artifacts/ipython_pygments_lexers_1737123620466/work
ipywidgets @ file:///home/conda/feedstock_root/build_artifacts/ipywidgets_1746454582739/work
isoduration @ file:///home/conda/feedstock_root/build_artifacts/isoduration_1733493628631/work/dist
jedi @ file:///home/conda/feedstock_root/build_artifacts/jedi_1733300866624/work
Jinja2 @ file:///home/conda/feedstock_root/build_artifacts/jinja2_1741263328855/work
joblib==1.5.1
json5 @ file:///home/conda/feedstock_root/build_artifacts/json5_1743722064131/work
jsonpointer @ file:///D:/bld/jsonpointer_1725302960531/work
jsonschema @ file:///home/conda/feedstock_root/build_artifacts/jsonschema_1748294245630/work
jsonschema-specifications @ file:///tmp/tmpuvkyqc9y/src
jupyter @ file:///home/conda/feedstock_root/build_artifacts/jupyter_1733818543322/work
jupyter-console @ file:///home/conda/feedstock_root/build_artifacts/jupyter_console_1733817997778/work
jupyter-events @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_jupyter_events_1738765986/work
jupyter-lsp @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_jupyter-lsp_1748550130/work/jupyter-lsp
jupyter_client @ file:///home/conda/feedstock_root/build_artifacts/jupyter_client_1733440914442/work
jupyter_core @ file:///D:/bld/jupyter_core_1748333031907/work
jupyter_server @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_jupyter_server_1747083217/work
jupyter_server_terminals @ file:///home/conda/feedstock_root/build_artifacts/jupyter_server_terminals_1733427956852/work
jupyterlab @ file:///home/conda/feedstock_root/build_artifacts/jupyterlab_1748272853841/work
jupyterlab-deck==0.2.0
jupyterlab_fonts==3.0.0
jupyterlab_myst==2.4.2
jupyterlab_pygments @ file:///home/conda/feedstock_root/build_artifacts/jupyterlab_pygments_1733328101776/work
jupyterlab_server @ file:///home/conda/feedstock_root/build_artifacts/jupyterlab_server_1733599573484/work
jupyterlab_widgets @ file:///home/conda/feedstock_root/build_artifacts/jupyterlab_widgets_1746450771080/work
jupytext @ file:///home/conda/feedstock_root/build_artifacts/jupytext_1748846543548/work
kiwisolver==1.4.8
llvmlite==0.44.0
markdown-it-py @ file:///home/conda/feedstock_root/build_artifacts/markdown-it-py_1733250460757/work
MarkupSafe @ file:///D:/bld/markupsafe_1733219614059/work
matplotlib==3.10.3
matplotlib-inline @ file:///home/conda/feedstock_root/build_artifacts/matplotlib-inline_1733416936468/work
mdit-py-plugins @ file:///home/conda/feedstock_root/build_artifacts/mdit-py-plugins_1733854715505/work
mdurl @ file:///home/conda/feedstock_root/build_artifacts/mdurl_1733255585584/work
mistune @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_mistune_1742402716/work
mpmath==1.3.0
multiprocess==0.70.18
nbclient @ file:///home/conda/feedstock_root/build_artifacts/nbclient_1734628800805/work
nbconvert @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_nbconvert-core_1738067871/work
nbformat @ file:///home/conda/feedstock_root/build_artifacts/nbformat_1733402752141/work
nbtoolbelt==2024.7.2
nest_asyncio @ file:///home/conda/feedstock_root/build_artifacts/nest-asyncio_1733325553580/work
nodeenv @ file:///home/conda/feedstock_root/build_artifacts/nodeenv_1734112117269/work
notebook @ file:///home/conda/feedstock_root/build_artifacts/notebook_1748278664848/work
notebook_shim @ file:///home/conda/feedstock_root/build_artifacts/notebook-shim_1733408315203/work
numba==0.61.2
numpy==1.26.4
openpyxl==3.1.5
optlang==1.8.3
overrides @ file:///home/conda/feedstock_root/build_artifacts/overrides_1734587627321/work
packaging @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_packaging_1745345660/work
pandas==2.3.0
pandocfilters @ file:///home/conda/feedstock_root/build_artifacts/pandocfilters_1631603243851/work
parso @ file:///home/conda/feedstock_root/build_artifacts/parso_1733271261340/work
pathos==0.3.4
pickleshare @ file:///home/conda/feedstock_root/build_artifacts/pickleshare_1733327343728/work
pillow==11.2.1
pkgutil_resolve_name @ file:///home/conda/feedstock_root/build_artifacts/pkgutil-resolve-name_1733344503739/work
platformdirs @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_platformdirs_1746710438/work
PolyRound==0.3.0
pox==0.3.6
ppft==1.7.7
pre_commit @ file:///home/conda/feedstock_root/build_artifacts/pre-commit_1742475552107/work
prometheus_client @ file:///home/conda/feedstock_root/build_artifacts/prometheus_client_1748896729786/work
prompt_toolkit @ file:///home/conda/feedstock_root/build_artifacts/prompt-toolkit_1744724089886/work
psutil @ file:///D:/bld/psutil_1740663127374/work
pure_eval @ file:///home/conda/feedstock_root/build_artifacts/pure_eval_1733569405015/work
pycparser @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_pycparser_1733195786/work
Pygments @ file:///home/conda/feedstock_root/build_artifacts/pygments_1750615794071/work
pymoo==0.6.1.5
pyparsing==3.2.3
PySocks @ file:///D:/bld/pysocks_1733217287171/work
python-dateutil @ file:///home/conda/feedstock_root/build_artifacts/python-dateutil_1733215673016/work
python-json-logger @ file:///home/conda/feedstock_root/build_artifacts/python-json-logger_1677079630776/work
pytz @ file:///home/conda/feedstock_root/build_artifacts/pytz_1742920838005/work
pywin32==307
pywinpty @ file:///D:/bld/pywinpty_1738660398038/work/target/wheels/pywinpty-2.0.15-cp311-none-win_amd64.whl#sha256=4b3edd3e28e0295d97879477b00080d2c3d801de92a868576e438cf99e083fe6
PyYAML @ file:///D:/bld/pyyaml_1737454660454/work
pyzmq @ file:///D:/bld/pyzmq_1749898448924/work
referencing @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_referencing_1737836872/work
requests @ file:///home/conda/feedstock_root/build_artifacts/requests_1749498106507/work
rfc3339_validator @ file:///home/conda/feedstock_root/build_artifacts/rfc3339-validator_1733599910982/work
rfc3986-validator @ file:///home/conda/feedstock_root/build_artifacts/rfc3986-validator_1598024191506/work
rpds-py @ file:///D:/bld/bld/rattler-build_rpds-py_1747837737/work
scikit-learn==1.7.0
scipy==1.16.0
Send2Trash @ file:///D:/bld/send2trash_1733322089150/work
six @ file:///home/conda/feedstock_root/build_artifacts/six_1733380938961/work
smmap @ file:///home/conda/feedstock_root/build_artifacts/smmap_1739781697784/work
sniffio @ file:///home/conda/feedstock_root/build_artifacts/sniffio_1733244044561/work
soupsieve @ file:///home/conda/feedstock_root/build_artifacts/soupsieve_1746563585861/work
stack_data @ file:///home/conda/feedstock_root/build_artifacts/stack_data_1733569443808/work
swiglpk==5.0.12
sympy==1.14.0
terminado @ file:///D:/bld/terminado_1710262761616/work
threadpoolctl==3.6.0
tinycss2 @ file:///home/conda/feedstock_root/build_artifacts/tinycss2_1729802851396/work
tomli @ file:///home/conda/feedstock_root/build_artifacts/tomli_1733256695513/work
tornado @ file:///D:/bld/tornado_1748003321906/work
tqdm==4.67.1
traitlets @ file:///home/conda/feedstock_root/build_artifacts/traitlets_1733367359838/work
types-python-dateutil @ file:///home/conda/feedstock_root/build_artifacts/types-python-dateutil_1747417193651/work
typing_extensions @ file:///home/conda/feedstock_root/build_artifacts/bld/rattler-build_typing_extensions_1748959427/work
typing_utils @ file:///home/conda/feedstock_root/build_artifacts/typing_utils_1733331286120/work
tzdata==2025.2
ukkonen @ file:///D:/bld/ukkonen_1725784158740/work
uri-template @ file:///home/conda/feedstock_root/build_artifacts/uri-template_1733323593477/work/dist
urllib3 @ file:///home/conda/feedstock_root/build_artifacts/urllib3_1750271362675/work
virtualenv @ file:///home/conda/feedstock_root/build_artifacts/virtualenv_1746781478212/work
wcwidth @ file:///home/conda/feedstock_root/build_artifacts/wcwidth_1733231326287/work
webcolors @ file:///home/conda/feedstock_root/build_artifacts/webcolors_1733359735138/work
webencodings @ file:///home/conda/feedstock_root/build_artifacts/webencodings_1733236011802/work
websocket-client @ file:///home/conda/feedstock_root/build_artifacts/websocket-client_1733157342724/work
widgetsnbextension @ file:///home/conda/feedstock_root/build_artifacts/widgetsnbextension_1744291053367/work
win_inet_pton @ file:///D:/bld/win_inet_pton_1733130564612/work
wrapt==1.17.2
xarray==2025.6.1
xarray-einstats==0.9.1
zipp @ file:///home/conda/feedstock_root/build_artifacts/zipp_1749421620841/work
zstandard==0.23.0
How to produce bug (including a minimal reproducible example)
from CADETProcess.simulator import Cadet
process_simulator = Cadet()
As I stated in my original post, it would be valuable for me to know why the .py file is not working. And how I can make it work (and also, how to make the Jupyter notebook work better).
Greetings, AN_IA
File produced by conda env export > environment.yml
environment.yml (8.25 KB)