adelenelai
/ remove_substr_matches_onebyone_20231014.ipynb
Created
October 15, 2023 21:31
Removing Substructure Matches and Returning Fragments in RDKit
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adelenelai
/ Cheminformatics for Risk Assessment of Transformation Products.ipynb
Created
June 25, 2023 19:49
risk-assessment-tps
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adelenelai
/ delete-one-match-at-a-time.ipynb
Created
July 12, 2022 06:40
delete-one-match-at-a-time_2022-07-12_adelenel.ai
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adelenelai
/ COCONUT_mongodb_goodies_3.ipynb
Created
April 20, 2022 05:13
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adelenelai
/ COCONUT_mongodb_goodies_2.ipynb
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April 20, 2022 04:37
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adelenelai
/ COCONUT_mongodb_goodies_1.ipynb
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April 20, 2022 04:38
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adelenelai
/ Explore-COCONUT-blog.ipynb
Created
March 17, 2022 08:50
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adelenelai
/ Explore-COCONUT-blog-old-plots.ipynb
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March 17, 2022 09:06
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adelenelai
/ top10boxplotshack_gist_20210217.ipynb
Created
February 18, 2021 06:35
blogpost at https://adelenel.ai
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/ DoubleBondStereo_MolBlockOutput.ipynb
Created
December 29, 2020 21:57
DoubleBondStereo_MolBlockOutput
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