TMAP script with COCONUT data used in SIDERITE paper
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The script and data used in SIDERITE paper to generate TMAP picture (Figure S3 in supplementart material). Requirement: tmap You can install tmap by conda. conda create -n tmap python=3.7 conda activate tmap conda install -c tmap tmap pip install faerun pip install matplotlib conda install scipy conda install -c rdkit rdkit conda install -c conda-forge mhfp Usage: python plot_COCONUT.py Then it will use COCONUT.csv to generate index.html and index.js. Open index.html to see result.
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Zenodo创建时间:
2023-12-13



