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iev_vae_env.yml
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iev_vae_env.yml
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name: iev_vae_env
channels:
- rdkit
- pytorch
- conda-forge
- nvidia
- defaults
dependencies:
- _libgcc_mutex=0.1=main
- _openmp_mutex=5.1=1_gnu
- blas=1.0=mkl
- bottleneck=1.3.5=py37h7deecbd_0
- brotlipy=0.7.0=py37h27cfd23_1003
- bzip2=1.0.8=h7b6447c_0
- ca-certificates=2023.12.12=h06a4308_0
- cairo=1.14.12=h8948797_3
- certifi=2022.12.7=py37h06a4308_0
- cffi=1.15.0=py37h7f8727e_0
- charset-normalizer=2.0.4=pyhd3eb1b0_0
- cryptography=39.0.1=py37h9ce1e76_0
- cuda=11.6.1=0
- cuda-cccl=11.6.55=hf6102b2_0
- cuda-command-line-tools=11.6.2=0
- cuda-compiler=11.6.2=0
- cuda-cudart=11.6.55=he381448_0
- cuda-cudart-dev=11.6.55=h42ad0f4_0
- cuda-cuobjdump=11.6.124=h2eeebcb_0
- cuda-cupti=11.6.124=h86345e5_0
- cuda-cuxxfilt=11.6.124=hecbf4f6_0
- cuda-driver-dev=11.6.55=0
- cuda-gdb=12.2.53=0
- cuda-libraries=11.6.1=0
- cuda-libraries-dev=11.6.1=0
- cuda-memcheck=11.8.86=0
- cuda-nsight=12.2.53=0
- cuda-nsight-compute=12.2.0=0
- cuda-nvcc=11.6.124=hbba6d2d_0
- cuda-nvdisasm=12.2.53=0
- cuda-nvml-dev=11.6.55=haa9ef22_0
- cuda-nvprof=12.2.60=0
- cuda-nvprune=11.6.124=he22ec0a_0
- cuda-nvrtc=11.6.124=h020bade_0
- cuda-nvrtc-dev=11.6.124=h249d397_0
- cuda-nvtx=11.6.124=h0630a44_0
- cuda-nvvp=12.2.60=0
- cuda-runtime=11.6.1=0
- cuda-samples=11.6.101=h8efea70_0
- cuda-sanitizer-api=12.2.53=0
- cuda-toolkit=11.6.1=0
- cuda-tools=11.6.1=0
- cuda-visual-tools=11.6.1=0
- cycler=0.11.0=pyhd8ed1ab_0
- expat=2.4.9=h6a678d5_0
- ffmpeg=4.3=hf484d3e_0
- fftw=3.3.9=h27cfd23_1
- fontconfig=2.14.1=h4c34cd2_2
- freetype=2.12.1=h4a9f257_0
- gds-tools=1.7.0.149=0
- giflib=5.2.1=h5eee18b_3
- glib=2.63.1=h5a9c865_0
- gmp=6.2.1=h295c915_3
- gnutls=3.6.15=he1e5248_0
- icu=58.2=he6710b0_3
- idna=3.4=py37h06a4308_0
- intel-openmp=2021.4.0=h06a4308_3561
- joblib=1.1.1=py37h06a4308_0
- jpeg=9e=h5eee18b_1
- kiwisolver=1.3.2=py37h2527ec5_1
- lame=3.100=h7b6447c_0
- lcms2=2.12=h3be6417_0
- lerc=3.0=h295c915_0
- libboost=1.73.0=h28710b8_12
- libcublas=11.9.2.110=h5e84587_0
- libcublas-dev=11.9.2.110=h5c901ab_0
- libcufft=10.7.1.112=hf425ae0_0
- libcufft-dev=10.7.1.112=ha5ce4c0_0
- libcufile=1.7.0.149=0
- libcufile-dev=1.7.0.149=0
- libcurand=10.3.3.53=0
- libcurand-dev=10.3.3.53=0
- libcusolver=11.3.4.124=h33c3c4e_0
- libcusparse=11.7.2.124=h7538f96_0
- libcusparse-dev=11.7.2.124=hbbe9722_0
- libdeflate=1.17=h5eee18b_0
- libedit=3.1.20221030=h5eee18b_0
- libffi=3.2.1=hf484d3e_1007
- libgcc-ng=11.2.0=h1234567_1
- libgfortran-ng=11.2.0=h00389a5_1
- libgfortran5=11.2.0=h1234567_1
- libgomp=11.2.0=h1234567_1
- libiconv=1.16=h7f8727e_2
- libidn2=2.3.4=h5eee18b_0
- libnpp=11.6.3.124=hd2722f0_0
- libnpp-dev=11.6.3.124=h3c42840_0
- libnvjpeg=11.6.2.124=hd473ad6_0
- libnvjpeg-dev=11.6.2.124=hb5906b9_0
- libpng=1.6.39=h5eee18b_0
- libstdcxx-ng=11.2.0=h1234567_1
- libtasn1=4.19.0=h5eee18b_0
- libtiff=4.5.0=h6a678d5_2
- libunistring=0.9.10=h27cfd23_0
- libuuid=1.41.5=h5eee18b_0
- libwebp=1.2.4=h11a3e52_1
- libwebp-base=1.2.4=h5eee18b_1
- libxcb=1.15=h7f8727e_0
- libxml2=2.10.3=hcbfbd50_0
- lz4-c=1.9.4=h6a678d5_0
- matplotlib=3.3.2=0
- matplotlib-base=3.3.2=py37h4f6019d_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=6.4=h6a678d5_0
- nettle=3.7.3=hbbd107a_1
- nsight-compute=2023.2.0.16=0
- numexpr=2.8.4=py37he184ba9_0
- numpy=1.21.5=py37h6c91a56_3
- numpy-base=1.21.5=py37ha15fc14_3
- openh264=2.1.1=h4ff587b_0
- openssl=1.0.2u=h7b6447c_0
- packaging=22.0=py37h06a4308_0
- pandas=1.3.5=py37h8c16a72_0
- pcre=8.45=h295c915_0
- pillow=9.4.0=py37h6a678d5_0
- pip=22.3.1=py37h06a4308_0
- pixman=0.40.0=h7f8727e_1
- py-boost=1.73.0=py37h51133e4_12
- pycparser=2.21=pyhd3eb1b0_0
- pyopenssl=23.0.0=py37h06a4308_0
- pyparsing=3.1.1=pyhd8ed1ab_0
- pysocks=1.7.1=py37_1
- python=3.7.0=h6e4f718_3
- python-dateutil=2.8.2=pyhd3eb1b0_0
- python_abi=3.7=2_cp37m
- pytorch=1.13.1=py3.7_cuda11.6_cudnn8.3.2_0
- pytorch-cuda=11.6=h867d48c_1
- pytorch-mutex=1.0=cuda
- pytz=2022.7=py37h06a4308_0
- rdkit=2020.09.1.0=py37hd50e099_1
- readline=7.0=h7b6447c_5
- requests=2.28.1=py37h06a4308_0
- scikit-learn=1.0.2=py37h51133e4_1
- scipy=1.7.3=py37h6c91a56_2
- seaborn=0.12.2=py37h06a4308_0
- setuptools=65.6.3=py37h06a4308_0
- six=1.16.0=pyhd3eb1b0_1
- sqlite=3.33.0=h62c20be_0
- threadpoolctl=2.2.0=pyh0d69192_0
- tk=8.6.12=h1ccaba5_0
- torchaudio=0.13.1=py37_cu116
- torchvision=0.14.1=py37_cu116
- tornado=6.1=py37h540881e_3
- tqdm=4.64.1=py37h06a4308_0
- typing_extensions=4.3.0=py37h06a4308_0
- urllib3=1.26.14=py37h06a4308_0
- wheel=0.38.4=py37h06a4308_0
- xz=5.4.2=h5eee18b_0
- zlib=1.2.13=h5eee18b_0
- zstd=1.5.5=hc292b87_0
- pip:
- appdirs==1.4.4
- click==8.1.7
- docker-pycreds==0.4.0
- gitdb==4.0.11
- gitpython==3.1.41
- importlib-metadata==6.7.0
- protobuf==4.24.4
- psutil==5.9.7
- pyyaml==6.0.1
- sentry-sdk==1.39.2
- setproctitle==1.3.3
- smmap==5.0.1
- zipp==3.15.0