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Python 3.11 TransitionPRs and Issues related to transitioning from Python 3.7 to 3.11PRs and Issues related to transitioning from Python 3.7 to 3.11abandonedabandoned issue/PR as determined by actions botabandoned issue/PR as determined by actions botstalestale issue/PR as determined by actions botstale issue/PR as determined by actions bot
Description
Motivation or Problem
Made for the March 2023 Hack-a-thon at northeastern, may spawn other smaller issues for individual dependencies.
The conda dependencies take a very long time to resolve, and are often simply incompatible with other packages. Packages like numpy, rdkit, cantera, etc. can be updated to a newer version or made more flexible.
Desired Solution
Run through the environment dependencies and determine which ones can be made less strict, switched to a new channel, or just updated.
name: rmg_env
channels:
- defaults
- rmg
- conda-forge
- cantera
dependencies:
- cairo
- cairocffi
- cantera::cantera=2.5
- conda-forge::cclib >=1.6.3
- rmg::chemprop
- coolprop
- coverage
- cython >=0.25.2
- rmg::diffeqpy
- ffmpeg
- rmg::gprof2dot
- graphviz
- h5py
- jinja2
- jupyter
- rmg::lpsolve55
- markupsafe
- matplotlib >=1.5
- rmg::mopac
- mpmath
- rmg::muq2
- networkx
- nomkl
- nose
- rmg::numdifftools
- numpy >=1.10.0
- conda-forge::openbabel >= 3
- pandas
- psutil
- rmg::pydas >=1.0.2
- pydot
- rmg::pydqed >=1.0.1
- rmg::pyjulia
- pymongo
- pyparsing
- rmg::pyrdl
- rmg::pyrms
- python >=3.7
- pyyaml
- rmg::quantities
- rmg::rdkit >=2020.03.3.0
- scikit-learn
- scipy
- rmg::symmetry
- xlrd
- xlwt
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Python 3.11 TransitionPRs and Issues related to transitioning from Python 3.7 to 3.11PRs and Issues related to transitioning from Python 3.7 to 3.11abandonedabandoned issue/PR as determined by actions botabandoned issue/PR as determined by actions botstalestale issue/PR as determined by actions botstale issue/PR as determined by actions bot