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Attempt to test against my pymatgen and custodian
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.circleci/config.yml

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@@ -15,7 +15,7 @@ jobs:
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export PATH=$HOME/miniconda3/bin:$PATH
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conda create --name test_env python=3.8
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source activate test_env
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conda install -c conda-forge openbabel pymatgen
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conda install -c conda-forge openbabel
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pip install -r requirements-ci.txt
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pip install .
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no_output_timeout: 1h

requirements-ci.txt

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git+git://github.com/samblau/pymatgen@qchem#egg=pymatgen
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git+git://github.com/samblau/custodian@qchem#egg=custodian
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boto3==1.17.97
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coverage==5.5
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moto==2.0.10

requirements.txt

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git+git://github.com/samblau/pymatgen@qchem#egg=pymatgen
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git+git://github.com/samblau/custodian@qchem#egg=custodian
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custodian==2022.1.17
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FireWorks==1.9.7
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maggma==0.44.0
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monty==2021.6.10
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paramiko==2.10.1
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pydash==5.0.0
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pymatgen-analysis-diffusion
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pymatgen
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pymongo
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pyyaml==5.4.1
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ruamel.yaml==0.17.9

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