DeepRLI/environment.yml at master · fairydance/DeepRLI · GitHub

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name: deeprli
channels:
  - pytorch
  - dglteam/label/cu118
  - nvidia
  - conda-forge
  - defaults
dependencies:
  - _libgcc_mutex=0.1=conda_forge
  - _openmp_mutex=4.5=2_kmp_llvm
  - blas=1.0=mkl
  - brotli=1.1.0=hd590300_1
  - brotli-bin=1.1.0=hd590300_1
  - brotli-python=1.0.9=py311h6a678d5_8
  - bzip2=1.0.8=h5eee18b_6
  - ca-certificates=2024.2.2=hbcca054_0
  - cairo=1.18.0=h3faef2a_0
  - certifi=2024.2.2=pyhd8ed1ab_0
  - chardet=5.2.0=py311h38be061_1
  - charset-normalizer=2.0.4=pyhd3eb1b0_0
  - contourpy=1.2.1=py311h9547e67_0
  - cuda-cudart=11.8.89=0
  - cuda-cupti=11.8.87=0
  - cuda-libraries=11.8.0=0
  - cuda-nvrtc=11.8.89=0
  - cuda-nvtx=11.8.86=0
  - cuda-runtime=11.8.0=0
  - cycler=0.12.1=pyhd8ed1ab_0
  - dgl=1.1.2.cu118=py311_0
  - expat=2.6.2=h59595ed_0
  - ffmpeg=4.3=hf484d3e_0
  - filelock=3.13.1=py311h06a4308_0
  - font-ttf-dejavu-sans-mono=2.37=hab24e00_0
  - font-ttf-inconsolata=3.000=h77eed37_0
  - font-ttf-source-code-pro=2.038=h77eed37_0
  - font-ttf-ubuntu=0.83=h77eed37_2
  - fontconfig=2.14.2=h14ed4e7_0
  - fonts-conda-ecosystem=1=0
  - fonts-conda-forge=1=0
  - fonttools=4.51.0=py311h459d7ec_0
  - freetype=2.12.1=h4a9f257_0
  - freetype-py=2.3.0=pyhd8ed1ab_0
  - gmp=6.2.1=h295c915_3
  - gmpy2=2.1.2=py311hc9b5ff0_0
  - gnutls=3.6.15=he1e5248_0
  - greenlet=3.0.3=py311hb755f60_0
  - icu=73.2=h59595ed_0
  - idna=3.7=py311h06a4308_0
  - intel-openmp=2023.1.0=hdb19cb5_46306
  - jinja2=3.1.3=py311h06a4308_0
  - jpeg=9e=h5eee18b_1
  - kiwisolver=1.4.5=py311h9547e67_1
  - lame=3.100=h7b6447c_0
  - lcms2=2.12=h3be6417_0
  - ld_impl_linux-64=2.38=h1181459_1
  - lerc=3.0=h295c915_0
  - libboost=1.82.0=h6fcfa73_6
  - libboost-python=1.82.0=py311h92ebd52_6
  - libbrotlicommon=1.1.0=hd590300_1
  - libbrotlidec=1.1.0=hd590300_1
  - libbrotlienc=1.1.0=hd590300_1
  - libcublas=11.11.3.6=0
  - libcufft=10.9.0.58=0
  - libcufile=1.9.1.3=0
  - libcurand=10.3.5.147=0
  - libcusolver=11.4.1.48=0
  - libcusparse=11.7.5.86=0
  - libdeflate=1.17=h5eee18b_1
  - libexpat=2.6.2=h59595ed_0
  - libffi=3.4.4=h6a678d5_1
  - libgcc-ng=13.2.0=h77fa898_6
  - libgfortran-ng=11.2.0=h00389a5_1
  - libgfortran5=11.2.0=h1234567_1
  - libglib=2.78.4=hdc74915_0
  - libiconv=1.16=h5eee18b_3
  - libidn2=2.3.4=h5eee18b_0
  - libnpp=11.8.0.86=0
  - libnsl=2.0.1=hd590300_0
  - libnvjpeg=11.9.0.86=0
  - libpng=1.6.39=h5eee18b_0
  - libsqlite=3.45.3=h2797004_0
  - libstdcxx-ng=13.2.0=hc0a3c3a_6
  - libtasn1=4.19.0=h5eee18b_0
  - libtiff=4.5.1=h6a678d5_0
  - libunistring=0.9.10=h27cfd23_0
  - libuuid=2.38.1=h0b41bf4_0
  - libwebp-base=1.3.2=h5eee18b_0
  - libxcb=1.15=h0b41bf4_0
  - libzlib=1.2.13=hd590300_5
  - llvm-openmp=18.1.4=ha31de31_0
  - lz4-c=1.9.4=h6a678d5_1
  - markupsafe=2.1.3=py311h5eee18b_0
  - matplotlib-base=3.8.0=py311h54ef318_1
  - mkl=2023.1.0=h213fc3f_46344
  - mkl-service=2.4.0=py311h5eee18b_1
  - mkl_fft=1.3.8=py311h5eee18b_0
  - mkl_random=1.2.4=py311hdb19cb5_0
  - mpc=1.1.0=h10f8cd9_1
  - mpfr=4.0.2=hb69a4c5_1
  - mpmath=1.3.0=py311h06a4308_0
  - munkres=1.1.4=pyh9f0ad1d_0
  - ncurses=6.4=h6a678d5_0
  - nettle=3.7.3=hbbd107a_1
  - networkx=3.1=py311h06a4308_0
  - numpy=1.26.4=py311h08b1b3b_0
  - numpy-base=1.26.4=py311hf175353_0
  - openh264=2.1.1=h4ff587b_0
  - openjpeg=2.4.0=h3ad879b_0
  - openssl=3.3.0=hd590300_0
  - packaging=24.0=pyhd8ed1ab_0
  - pandas=2.2.2=py311h320fe9a_0
  - pcre2=10.42=hcad00b1_0
  - pillow=10.3.0=py311h5eee18b_0
  - pip=23.3.1=py311h06a4308_0
  - pixman=0.43.2=h59595ed_0
  - psutil=5.9.0=py311h5eee18b_0
  - pthread-stubs=0.4=h36c2ea0_1001
  - pycairo=1.26.0=py311h8feb60e_0
  - pyparsing=3.1.2=pyhd8ed1ab_0
  - pysocks=1.7.1=py311h06a4308_0
  - python=3.11.5=hab00c5b_0_cpython
  - python-dateutil=2.9.0=pyhd8ed1ab_0
  - python-tzdata=2024.1=pyhd8ed1ab_0
  - python_abi=3.11=4_cp311
  - pytorch=2.0.1=py3.11_cuda11.8_cudnn8.7.0_0
  - pytorch-cuda=11.8=h7e8668a_5
  - pytorch-mutex=1.0=cuda
  - pytz=2024.1=pyhd8ed1ab_0
  - rdkit=2023.09.2=py311h4c2f14b_0
  - readline=8.2=h5eee18b_0
  - reportlab=4.1.0=py311h459d7ec_0
  - requests=2.31.0=py311h06a4308_1
  - rlpycairo=0.2.0=pyhd8ed1ab_0
  - scipy=1.11.4=py311h08b1b3b_0
  - setuptools=68.2.2=py311h06a4308_0
  - six=1.16.0=pyh6c4a22f_0
  - sqlalchemy=1.4.49=py311h459d7ec_1
  - sqlite=3.45.3=h5eee18b_0
  - sympy=1.12=py311h06a4308_0
  - tbb=2021.8.0=hdb19cb5_0
  - tk=8.6.12=h1ccaba5_0
  - torchaudio=2.0.2=py311_cu118
  - torchtriton=2.0.0=py311
  - torchvision=0.15.2=py311_cu118
  - tqdm=4.66.2=py311h92b7b1e_0
  - typing_extensions=4.9.0=py311h06a4308_1
  - tzdata=2024a=h04d1e81_0
  - urllib3=2.1.0=py311h06a4308_1
  - wheel=0.43.0=py311h06a4308_0
  - xorg-kbproto=1.0.7=h7f98852_1002
  - xorg-libice=1.1.1=hd590300_0
  - xorg-libsm=1.2.4=h7391055_0
  - xorg-libx11=1.8.9=h8ee46fc_0
  - xorg-libxau=1.0.11=hd590300_0
  - xorg-libxdmcp=1.1.3=h7f98852_0
  - xorg-libxext=1.3.4=h0b41bf4_2
  - xorg-libxrender=0.9.11=hd590300_0
  - xorg-renderproto=0.11.1=h7f98852_1002
  - xorg-xextproto=7.3.0=h0b41bf4_1003
  - xorg-xproto=7.0.31=h7f98852_1007
  - xz=5.4.6=h5eee18b_1
  - zlib=1.2.13=hd590300_5
  - zstd=1.5.5=hc292b87_2
prefix: /home/hylin/.local/miniconda3/envs/deeprli