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update readme

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  1. README.md +14 -14
README.md CHANGED
@@ -12,34 +12,34 @@ configs:
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  path: "affinity-data-combined.parquet"
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  - split: davis
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  path: "davis.csv"
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- - split: davis-filtered
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  path: "davis-filtered.csv"
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  - split: kiba
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  path: "kiba.csv"
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- - split: pdbbind-2020-combined
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  path: "pdbbind-2020-combined.csv"
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- - split: pdbbind-2020-refined
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  path: "pdbbind-2020-refined.csv"
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- - split: bindingdb-ic50
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  path: "bindingdb-ic50.csv"
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- - split: bindingdb-ki
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  path: "bindingdb-ki.csv"
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- - split: bindingdb-ki-filtered
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  path: "bindingdb-ki-filtered.csv"
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- - split: bindingdb-kd
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  path: "bindingdb-kd.csv"
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  - split: glaser
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  path: "glaser.csv"
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  ---
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  ## Data Sources
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- bindingdb-ic50.csv: https://tdcommons.ai/ (tdc python package)
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- bindingdb-kd.csv: https://tdcommons.ai/ (tdc python package)
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- bindingdb-kd-filtered.csv: filtered manually (see standardize_data.ipynb)
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- bindingdb-ki.csv: https://tdcommons.ai/ (tdc python package)
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  davis.csv: https://tdcommons.ai/ (tdc python package)
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- davis-filtered.csv: https://www.kaggle.com/datasets/christang0002/davis-and-kiba
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  kiba.csv: https://tdcommons.ai/ (tdc python package)
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- pdbbind-2020-combined.csv: https://www.pdbbind.org.cn/
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- pdbbind-2020-refined.csv: https://www.pdbbind.org.cn/
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  glaser.csv: https://huggingface.co/datasets/jglaser/binding_affinity
 
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  path: "affinity-data-combined.parquet"
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  - split: davis
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  path: "davis.csv"
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+ - split: davis_filtered
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  path: "davis-filtered.csv"
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  - split: kiba
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  path: "kiba.csv"
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+ - split: pdbbind_2020_combined
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  path: "pdbbind-2020-combined.csv"
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+ - split: pdbbind_2020_refined
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  path: "pdbbind-2020-refined.csv"
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+ - split: bindingdb_ic50
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  path: "bindingdb-ic50.csv"
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+ - split: bindingdb_ki
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  path: "bindingdb-ki.csv"
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+ - split: bindingdb_ki_filtered
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  path: "bindingdb-ki-filtered.csv"
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+ - split: bindingdb_kd
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  path: "bindingdb-kd.csv"
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  - split: glaser
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  path: "glaser.csv"
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  ---
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  ## Data Sources
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+ bindingdb_ic50.csv: https://tdcommons.ai/ (tdc python package)
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+ bindingdb_kd.csv: https://tdcommons.ai/ (tdc python package)
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+ bindingdb_kd_filtered.csv: filtered manually (see standardize_data.ipynb)
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+ bindingdb_ki.csv: https://tdcommons.ai/ (tdc python package)
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  davis.csv: https://tdcommons.ai/ (tdc python package)
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+ davis_filtered.csv: https://www.kaggle.com/datasets/christang0002/davis-and-kiba
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  kiba.csv: https://tdcommons.ai/ (tdc python package)
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+ pdbbind_2020_combined.csv: https://www.pdbbind.org.cn/
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+ pdbbind_2020_refined.csv: https://www.pdbbind.org.cn/
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  glaser.csv: https://huggingface.co/datasets/jglaser/binding_affinity