JTVAE_rd2018.yml

name: JTVAE_rd2018
channels:
  - rdkit
  - defaults
dependencies:
  - _libgcc_mutex=0.1=main
  - _openmp_mutex=5.1=1_gnu
  - blas=1.0=mkl
  - bottleneck=1.3.5=py37h7deecbd_0
  - bzip2=1.0.8=h7b6447c_0
  - ca-certificates=2022.07.19=h06a4308_0
  - cairo=1.16.0=h19f5f5c_2
  - certifi=2022.9.24=py37h06a4308_0
  - fontconfig=2.13.1=h6c09931_0
  - freetype=2.11.0=h70c0345_0
  - giflib=5.2.1=h7b6447c_0
  - glib=2.69.1=h4ff587b_1
  - icu=58.2=he6710b0_3
  - intel-openmp=2021.4.0=h06a4308_3561
  - jpeg=9e=h7f8727e_0
  - lcms2=2.12=h3be6417_0
  - ld_impl_linux-64=2.38=h1181459_1
  - lerc=3.0=h295c915_0
  - libboost=1.67.0=h46d08c1_4
  - libdeflate=1.8=h7f8727e_5
  - libffi=3.3=he6710b0_2
  - libgcc-ng=11.2.0=h1234567_1
  - libgomp=11.2.0=h1234567_1
  - libpng=1.6.37=hbc83047_0
  - libstdcxx-ng=11.2.0=h1234567_1
  - libtiff=4.4.0=hecacb30_0
  - libuuid=1.0.3=h7f8727e_2
  - libwebp=1.2.4=h11a3e52_0
  - libwebp-base=1.2.4=h5eee18b_0
  - libxcb=1.15=h7f8727e_0
  - libxml2=2.9.14=h74e7548_0
  - lz4-c=1.9.3=h295c915_1
  - mkl=2021.4.0=h06a4308_640
  - mkl-service=2.4.0=py37h7f8727e_0
  - mkl_fft=1.3.1=py37hd3c417c_0
  - mkl_random=1.2.2=py37h51133e4_0
  - ncurses=6.3=h5eee18b_3
  - numexpr=2.8.3=py37h807cd23_0
  - numpy=1.21.5=py37h6c91a56_3
  - numpy-base=1.21.5=py37ha15fc14_3
  - openssl=1.1.1q=h7f8727e_0
  - packaging=21.3=pyhd3eb1b0_0
  - pandas=1.3.5=py37h8c16a72_0
  - pcre=8.45=h295c915_0
  - pillow=9.2.0=py37hace64e9_1
  - pip=22.2.2=py37h06a4308_0
  - pixman=0.40.0=h7f8727e_1
  - py-boost=1.67.0=py37h04863e7_4
  - pyparsing=3.0.9=py37h06a4308_0
  - python=3.7.13=h12debd9_0
  - python-dateutil=2.8.2=pyhd3eb1b0_0
  - pytz=2022.1=py37h06a4308_0
  - rdkit=2018.09.3.0=py37hc20afe1_1
  - readline=8.1.2=h7f8727e_1
  - setuptools=63.4.1=py37h06a4308_0
  - six=1.16.0=pyhd3eb1b0_1
  - sqlite=3.39.3=h5082296_0
  - tk=8.6.12=h1ccaba5_0
  - wheel=0.37.1=pyhd3eb1b0_0
  - xz=5.2.6=h5eee18b_0
  - zlib=1.2.12=h5eee18b_3
  - zstd=1.5.2=ha4553b6_0
  - pip:
    - cycler==0.11.0
    - fonttools==4.37.4
    - kiwisolver==1.4.4
    - matplotlib==3.5.3
    - networkx==2.6.3
    - scipy==1.5.4
    - seaborn==0.12.1
    - typing-extensions==4.4.0
prefix: /storage/fong/anaconda3/envs/JTVAE_rd2018