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environment.yml
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name: remove_duplicates
channels:
- openbabel
- defaults
dependencies:
- alabaster=0.7.12=py37_0
- asn1crypto=0.24.0=py37_0
- atomicwrites=1.3.0=py37_1
- attrs=19.1.0=py37_1
- babel=2.6.0=py37_0
- blas=1.0=mkl
- bzip2=1.0.6=h14c3975_5
- ca-certificates=2019.1.23=0
- cairo=1.14.12=h8948797_3
- certifi=2019.3.9=py37_0
- cffi=1.12.2=py37h2e261b9_1
- chardet=3.0.4=py37_1
- coverage=4.5.3=py37h7b6447c_0
- cryptography=2.6.1=py37h1ba5d50_0
- docutils=0.14=py37_0
- fontconfig=2.13.0=h9420a91_0
- freetype=2.9.1=h8a8886c_1
- glib=2.56.2=hd408876_0
- icu=58.2=h9c2bf20_1
- idna=2.8=py37_0
- imagesize=1.1.0=py37_0
- intel-openmp=2019.3=199
- jinja2=2.10=py37_0
- libedit=3.1.20181209=hc058e9b_0
- libffi=3.2.1=hd88cf55_4
- libgcc=7.2.0=h69d50b8_2
- libgcc-ng=8.2.0=hdf63c60_1
- libgfortran-ng=7.3.0=hdf63c60_0
- libpng=1.6.36=hbc83047_0
- libstdcxx-ng=8.2.0=hdf63c60_1
- libuuid=1.0.3=h1bed415_2
- libxcb=1.13=h1bed415_1
- libxml2=2.9.9=he19cac6_0
- llvmlite=0.28.0=py37hd408876_0
- markupsafe=1.1.1=py37h7b6447c_0
- mkl=2019.3=199
- mkl_fft=1.0.10=py37ha843d7b_0
- mkl_random=1.0.2=py37hd81dba3_0
- more-itertools=6.0.0=py37_0
- ncurses=6.1=he6710b0_1
- numba=0.43.1=py37h962f231_0
- numpy-base=1.16.2=py37hde5b4d6_0
- openbabel=2.4.1=py37_5
- openssl=1.1.1b=h7b6447c_1
- packaging=19.0=py37_0
- pcre=8.43=he6710b0_0
- pip=19.0.3=py37_0
- pixman=0.38.0=h7b6447c_0
- pluggy=0.9.0=py37_0
- py=1.8.0=py37_0
- pycparser=2.19=py37_0
- pygments=2.3.1=py37_0
- pyopenssl=19.0.0=py37_0
- pyparsing=2.3.1=py37_0
- pysocks=1.6.8=py37_0
- pytest=4.3.1=py37_0
- pytest-cov=2.6.1=py37_0
- python=3.7.2=h0371630_0
- pytz=2018.9=py37_0
- readline=7.0=h7b6447c_5
- requests=2.21.0=py37_0
- scikit-learn=0.20.3=py37hd81dba3_0
- setuptools=40.8.0=py37_0
- six=1.12.0=py37_0
- snowballstemmer=1.2.1=py37_0
- sphinx=1.8.5=py37_0
- sphinx_rtd_theme=0.4.3=py_0
- sphinxcontrib=1.0=py37_1
- sphinxcontrib-websupport=1.1.0=py37_1
- sqlite=3.27.2=h7b6447c_0
- tk=8.6.8=hbc83047_0
- tqdm=4.31.1=py37_1
- urllib3=1.24.1=py37_0
- wheel=0.33.1=py37_0
- xz=5.2.4=h14c3975_4
- zlib=1.2.11=h7b6447c_3
- pip:
- ase==3.17.0
- click==7.0
- cycler==0.10.0
- decorator==4.4.0
- flask==1.0.2
- itsdangerous==1.1.0
- kiwisolver==1.0.1
- latexcodec==1.0.6
- matplotlib==3.0.3
- monty==1.0.6
- mpmath==1.1.0
- networkx==2.2
- numpy==1.16.2
- oset==0.1.3
- palettable==3.1.1
- pandas==0.24.2
- pybtex==0.22.2
- pybtex-docutils==0.2.1
- pycifrw==4.4.1
- pydispatcher==2.0.5
- pymatgen==2019.3.13
- python-dateutil==2.8.0
- pyyaml==5.1
- ruamel-yaml==0.15.89
- scipy==1.2.1
- spglib==1.12.2.post0
- sphinxcontrib-bibtex==0.4.2
- sympy==1.3
- tabulate==0.8.3
- werkzeug==0.15.1