iDNABinder is an in-house specific molecular docking tool for DNA-ligand docking, whose scoring function comprises DNA-specific knowledge-based and force field-based scoring functions. It could be used to screen for small molecular docking or virtual screening against the specific DNA sequence and has been successfully applied to identifying potent natural modulator of AP-1, which selectively binds to a specific site (TRE 5`-TGACTCA-3`) of the AP-1 target DNA sequence and regulates AP-1-dependent gene transcription.
Copyright © 2024 Prof. HongLin Li's Group, School of Pharmacy, East China University of Science & Technology · All Right Reserved.
沪ICP备19004698号-1 | 沪公网安备31011302004713号