Molecular mechanism of Ginseng against High altitude polycythemia based on network pharmacology, molecular docking, and molecular dynamics simulations
docking input files, receptor structures, ligand protonation states, docking boxes, and output poses. AMBER input files, force-field parameter files, ligand charge derivation files, and analysis scripts.Deposit processed trajectory-analysis data used for RMSD, RMSF, MM-GBSA, and residue decom
docking input files, receptor structures, ligand protonation states, docking boxes, and output poses. AMBER input files, force-field parameter files, ligand charge derivation files, and analysis scripts.
Deposit processed trajectory-analysis data used for RMSD, RMSF, MM-GBSA, and residue decomposition. State software versions and database access dates consistently.
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Files are hosted on the source repository. Click download to access the full dataset.