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Diffusion Transformation Product Prediction 2c7fcecb6ac0

ADD: obtain reaction file with EC numbers as additional output.
2c7fcecb6ac0
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Authored by Jasmin on May 5 2023, 13:51.

Description

ADD: obtain reaction file with EC numbers as additional output.

Details

Committed
JasminMay 5 2023, 13:51
Pushed
hafnerjaMay 5 2023, 13:53
Parents
R12460:b3fc7cd5bb74: LIB: dependency installation and handling
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Changes (11)

Path
MTP_prediction/find_best_TPs.py
A(dir)TP_prediction/output/
ATP_prediction/output/TP_prediction_TEST_Sema_20.tsv
ATP_prediction/output/TP_prediction_TEST_top_2.tsv
ATP_prediction/output/TP_prediction_TEST_top_20.tsv
ATP_prediction/output/TP_prediction_TEST_top_3.tsv
ATP_prediction/output/reaction_prediction_Sema_top_20.tsv
ATP_prediction/output/reaction_prediction_TEST_top_2.tsv
ATP_prediction/output/reaction_prediction_TEST_top_20.tsv
ATP_prediction/output/reaction_prediction_TEST_top_3.tsv
MTP_prediction/util.py

R12460:2c7fcecb6ac0

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TP_prediction/find_best_TPs.py

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TP_prediction/output/TP_prediction_TEST_Sema_20.tsv

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TP_prediction/output/TP_prediction_TEST_top_2.tsv

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TP_prediction/output/TP_prediction_TEST_top_20.tsv

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TP_prediction/output/TP_prediction_TEST_top_3.tsv

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TP_prediction/output/reaction_prediction_Sema_top_20.tsv

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TP_prediction/output/reaction_prediction_TEST_top_2.tsv

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TP_prediction/output/reaction_prediction_TEST_top_20.tsv

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TP_prediction/output/reaction_prediction_TEST_top_3.tsv

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TP_prediction/util.py

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