Lang2mol-Diff / environment.yaml
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name: molecule
channels:
- defaults
dependencies:
- _libgcc_mutex=0.1=main
- _openmp_mutex=5.1=1_gnu
- bzip2=1.0.8=h5eee18b_5
- ca-certificates=2024.3.11=h06a4308_0
- ld_impl_linux-64=2.38=h1181459_1
- libffi=3.4.4=h6a678d5_0
- libgcc-ng=11.2.0=h1234567_1
- libgfortran-ng=7.5.0=ha8ba4b0_17
- libgfortran4=7.5.0=ha8ba4b0_17
- libgomp=11.2.0=h1234567_1
- libstdcxx-ng=11.2.0=h1234567_1
- libuuid=1.41.5=h5eee18b_0
- mpi=1.0=mpich
- mpi4py=3.1.4=py311hfc96bbd_0
- mpich=3.3.2=hc856adb_0
- ncurses=6.4=h6a678d5_0
- openssl=3.0.13=h7f8727e_0
- pip=23.3.1=py311h06a4308_0
- python=3.11.9=h955ad1f_0
- readline=8.2=h5eee18b_0
- setuptools=68.2.2=py311h06a4308_0
- sqlite=3.41.2=h5eee18b_0
- tk=8.6.12=h1ccaba5_0
- wheel=0.41.2=py311h06a4308_0
- xz=5.4.6=h5eee18b_0
- zlib=1.2.13=h5eee18b_0
- pip:
- aiohttp==3.9.5
- aiosignal==1.3.1
- annotated-types==0.6.0
- appdirs==1.4.4
- attrs==23.2.0
- blis==0.7.11
- blobfile==2.1.1
- catalogue==2.0.10
- certifi==2024.2.2
- charset-normalizer==3.3.2
- click==8.1.7
- cloudpathlib==0.16.0
- confection==0.1.4
- cymem==2.0.8
- datasets==2.19.0
- dill==0.3.8
- docker-pycreds==0.4.0
- fcd==1.2.2
- filelock==3.13.4
- frozenlist==1.4.1
- fsspec==2024.3.1
- gitdb==4.0.11
- gitpython==3.1.43
- huggingface-hub==0.22.2
- idna==3.7
- jinja2==3.1.3
- joblib==1.4.0
- levenshtein==0.25.1
- lxml==4.9.4
- markupsafe==2.1.5
- mpmath==1.3.0
- multidict==6.0.5
- multiprocess==0.70.16
- murmurhash==1.0.10
- networkx==3.2.1
- nltk==3.8.1
- numpy==1.26.4
- nvidia-cublas-cu12==12.1.3.1
- nvidia-cuda-cupti-cu12==12.1.105
- nvidia-cuda-nvrtc-cu12==12.1.105
- nvidia-cuda-runtime-cu12==12.1.105
- nvidia-cudnn-cu12==8.9.2.26
- nvidia-cufft-cu12==11.0.2.54
- nvidia-curand-cu12==10.3.2.106
- nvidia-cusolver-cu12==11.4.5.107
- nvidia-cusparse-cu12==12.1.0.106
- nvidia-nccl-cu12==2.20.5
- nvidia-nvjitlink-cu12==12.4.127
- nvidia-nvtx-cu12==12.1.105
- packaging==24.0
- pandas==2.2.1
- pfzy==0.3.4
- pillow==10.3.0
- preshed==3.0.9
- prompt-toolkit==3.0.43
- protobuf==4.25.3
- psutil==5.9.8
- pyarrow==15.0.2
- pyarrow-hotfix==0.6
- pycryptodomex==3.20.0
- pydantic==2.6.4
- pydantic-core==2.16.3
- python-dateutil==2.9.0.post0
- pytz==2024.1
- pyyaml==6.0.1
- rapidfuzz==3.8.1
- rdkit==2023.9.5
- regex==2023.12.25
- requests==2.31.0
- safetensors==0.4.2
- scipy==1.13.0
- selfies==2.1.1
- sentry-sdk==1.44.1
- setproctitle==1.3.3
- six==1.16.0
- smart-open==6.4.0
- smmap==5.0.1
- spacy-legacy==3.0.12
- spacy-loggers==1.0.5
- srsly==2.4.8
- sympy==1.12
- thinc==8.2.3
- tokenizers==0.15.2
- torch==2.3.0
- tqdm==4.66.2
- transformers==4.39.3
- triton==2.3.0
- typer==0.9.4
- typing-extensions==4.10.0
- tzdata==2024.1
- urllib3==2.2.1
- wandb==0.16.6
- wasabi==1.1.2
- wcwidth==0.2.13
- weasel==0.3.4
- xxhash==3.4.1
- yarl==1.9.4
prefix: /opt/conda/envs/molecule