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1 parent c9d8079 commit c6a2c13Copy full SHA for c6a2c13
conda.yml
@@ -1,4 +1,4 @@
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-name: toxsmi_test
+name: toxsmi
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channels:
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- https://conda.anaconda.org/rdkit
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dependencies:
@@ -7,7 +7,7 @@ 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
+ - 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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