Computational drug discovery project using molecular docking, virtual screening, and ADME analysis to identify plant-derived DNMT1 inhibitors against colorectal cancer using AlphaFold, AutoDock Vina, PyRx, SwissADME, TCGA, and CPTAC datasets.
bioinformatics computational-biology epigenetics drug-discovery drug-design tcga-data virtual-screening molecular-docking autodock-vina alphafold colorectal-cancer pubchem-database dnmt1 pyrx cancer-bioinformatics swissadme plant-derived-compounds
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Updated
Jul 28, 2026