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* cyototox data paramareters adaptation. * Update README.md * Revert "cyototox data paramareters adaptation." This reverts commit df36685. * Revert "Update README.md" This reverts commit fafdf77. * name: toxsmi_test -> toxsmi
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conda.yml

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name: toxsmi_test
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name: toxsmi
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channels:
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- https://conda.anaconda.org/rdkit
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dependencies:
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- pip>=19.1
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- pip:
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- pytoda @ git+https://github.com/PaccMann/paccmann_datasets@0.1.1
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- paccmann_predictor @ git+https://github.com/PaccMann/paccmann_predictor@0.0.2
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- paccmann_predictor @ git+https://github.com/PaccMann/paccmann_predictor@0.0.2
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- numpy>=1.14.3
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- torch==1.5.1
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- deepchem>=2.4

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