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about MMPA in the paper "Quantitative Evaluation of Explainable Graph Neural Networks for Molecular Property Prediction"

Status: Open.

#12 In biomed-AI/MolRep;

· wjxts opened on Oct 28, 2024

Feature extraction

Status: Open.

#10 In biomed-AI/MolRep;

· xixinhy opened on Sep 21, 2022

doesn't Install with the install.sh in cpu version

Status: Open.

#9 In biomed-AI/MolRep;

· mahimanzum opened on May 28, 2022

Datesets

Status: Open.

#8 In biomed-AI/MolRep;

· peachchange opened on Mar 25, 2022

MolRep/MolRep/Evaluations/model_assessment/KFoldAssessment.py

Status: Open.

#7 In biomed-AI/MolRep;

· dywlkji opened on Dec 3, 2021

hyper-training_with_grid_search.ipynb failed due to MorganFP model is not in config dict

Status: Open.

#6 In biomed-AI/MolRep;

· kopwei opened on Sep 7, 2021