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GitHub / hnlab / can-ai-do
Predicting or pretending: artificial intelligence for protein-ligand interactions lack of sufficiently large and unbiased datasets
JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/hnlab%2Fcan-ai-do
Stars: 13
Forks: 3
Open Issues: 1
License: mit
Language: UnrealScript
Repo Size: 42.7 MB
Dependencies:
177
Created: over 5 years ago
Updated: about 1 year ago
Last pushed: over 3 years ago
Last synced: about 1 year ago
Topics: project
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Dependencies
tutorial/environment.yml
conda
- _libgcc_mutex 0.1
- _openmp_mutex 4.5
- _py-xgboost-mutex 2.0
- _tflow_select 2.3.0
- absl-py 0.9.0
- astor 0.7.1
- attrs 19.3.0
- backcall 0.1.0
- bleach 3.1.0
- blosc 1.17.0
- bzip2 1.0.8
- c-ares 1.15.0
- ca-certificates 2019.11.28
- cairo 1.16.0
- certifi 2019.11.28
- cffi 1.13.2
- chardet 3.0.4
- cryptography 2.8
- cycler 0.10.0
- cython 0.29.14
- dbus 1.13.6
- decorator 4.4.1
- deepchem 2.3.0
- defusedxml 0.6.0
- entrypoints 0.3
- expat 2.2.5
- fftw3f 3.3.4
- fontconfig 2.13.1
- freetype 2.10.0
- gast 0.3.2
- gettext 0.19.8.1
- glib 2.58.3
- google-pasta 0.1.8
- grpcio 1.23.0
- gst-plugins-base 1.14.5
- gstreamer 1.14.5
- h5py 2.10.0
- hdf5 1.10.5
- icu 58.2
- idna 2.8
- importlib_metadata 1.3.0
- ipykernel 5.1.3
- ipython 7.11.1
- ipython_genutils 0.2.0
- ipywidgets 7.5.1
- jedi 0.15.2
- jinja2 2.10.3
- joblib 0.14.1
- jpeg 9c
- jsonschema 3.2.0
- jupyter 1.0.0
- jupyter_client 5.3.4
- jupyter_console 5.1.0
- jupyter_core 4.6.1
- keras-applications 1.0.8
- keras-preprocessing 1.1.0
- kiwisolver 1.1.0
- libblas 3.8.0
- libboost 1.67.0
- libcblas 3.8.0
- libffi 3.2.1
- libgcc-ng 9.2.0
- libgfortran-ng 7.3.0
- libgomp 9.2.0
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- liblapack 3.8.0
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- libpng 1.6.37
- libprotobuf 3.11.2
- libsodium 1.0.17
- libstdcxx-ng 9.2.0
- libtiff 4.1.0
- libuuid 2.32.1
- libxcb 1.13
- libxgboost 0.90
- libxml2 2.9.9
- lz4-c 1.8.3
- lzo 2.10
- markdown 3.1.1
- markupsafe 1.1.1
- matplotlib 3.1.1
- matplotlib-base 3.1.1
- mdtraj 1.9.1
- mistune 0.8.4
- mock 3.0.5
- more-itertools 8.0.2
- nbconvert 5.6.1
- nbformat 5.0.3
- ncurses 6.1
- networkx 2.4
- notebook 6.0.1
- numexpr 2.7.1
- numpy 1.17.3
- olefile 0.46
- openmm 7.4.1
- openssl 1.1.1d
- pandas 0.25.3
- pandoc 2.9.1.1
- pandocfilters 1.4.2
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- patsy 0.5.1
- pcre 8.43
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- pillow 7.0.0
- pip 19.3.1
- pixman 0.38.0
- prometheus_client 0.7.1
- prompt_toolkit 3.0.2
- protobuf 3.11.2
- pthread-stubs 0.4
- ptyprocess 0.6.0
- py-boost 1.67.0
- py-xgboost 0.90
- pycparser 2.19
- pygments 2.5.2
- pyopenssl 19.1.0
- pyparsing 2.4.6
- pyqt 5.9.2
- pyrsistent 0.15.7
- pysocks 1.7.1
- pytables 3.6.1
- python 3.6.7
- python-dateutil 2.8.1
- pytz 2019.3
- pyzmq 18.1.1
- qt 5.9.7
- qtconsole 4.6.0
- rdkit 2019.09.3.0
- readline 8.0
- requests 2.22.0
- scikit-learn 0.22.1
- scipy 1.4.1
- seaborn 0.9.0
- send2trash 1.5.0
- setuptools 44.0.0
- simdna 0.4.2
- sip 4.19.8
- six 1.13.0
- sqlite 3.30.1
- statsmodels 0.10.2
- tensorboard 1.14.0
- tensorflow 1.14.0
- tensorflow-base 1.14.0
- tensorflow-estimator 1.14.0
- termcolor 1.1.0
- terminado 0.8.3
- testpath 0.4.4
- tk 8.6.10
- tornado 6.0.3
- tqdm 4.41.1
- traitlets 4.3.3
- urllib3 1.25.7
- wcwidth 0.1.8
- webencodings 0.5.1
- werkzeug 0.16.0
- wheel 0.33.6
- widgetsnbextension 3.5.1
- wrapt 1.11.2
- xgboost 0.90
- xorg-kbproto 1.0.7
- xorg-libice 1.0.10
- xorg-libsm 1.2.3
- xorg-libx11 1.6.9
- xorg-libxau 1.0.9
- xorg-libxdmcp 1.1.3
- xorg-libxext 1.3.4
- xorg-libxrender 0.9.10
- xorg-renderproto 0.11.1
- xorg-xextproto 7.3.0
- xorg-xproto 7.0.31
- xz 5.2.4
- zeromq 4.3.2
- zipp 0.6.0
- zlib 1.2.11
- zstd 1.4.4