Researches about Monkeypox virus
License: MIT License
Researches about Monkeypox virus
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├── LICENSE
├── README.md
└── tecovirimat # files for tecovirimat docking to Envelope protein F13
├── F13.pdb
├── F13_pocket.pdb
├── all.sh
├── get_box_center.sh
├── lig.pdb
└── lig_mini_out.pdbqt # docking results
You may need openbable, ADFR and vina already installed! Or you can simple open F13.pdb and lig_mini_out.pdbqt using pymol
# for running docking by youself
cd tecovirimat
bash +x all.sh
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