Challenges, Applications, and Recent Advances of Protein-Ligand Docking in Structure-Based Drug Design
The docking methods used in structure-based virtual database screening offer the ability to quickly and cheaply estimate the affinity and binding mode of a ligand for the protein receptor of interest, such as a drug target. These methods can be used to enrich a database of compounds, so that more co...
Main Authors: | Sam Z. Grinter, Xiaoqin Zou |
---|---|
Format: | Article |
Language: | English |
Published: |
MDPI AG
2014-07-01
|
Series: | Molecules |
Subjects: | |
Online Access: | http://www.mdpi.com/1420-3049/19/7/10150 |
Similar Items
-
Advances and Challenges in Protein-Ligand Docking
by: Xiaoqin Zou, et al.
Published: (2010-08-01) -
Recent Advances in Molecular Docking for the Research and Discovery of Potential Marine Drugs
by: Guilin Chen, et al.
Published: (2020-10-01) -
CoDock-Ligand: combined template-based docking and CNN-based scoring in ligand binding prediction
by: Mingwei Pang, et al.
Published: (2023-11-01) -
Identification by Molecular Docking of Homoisoflavones from Leopoldia comosa as Ligands of Estrogen Receptors
by: Fedora Grande, et al.
Published: (2018-04-01) -
An accurate and universal protein-small molecule batch docking solution using Autodock Vina
by: Xinhao Che, et al.
Published: (2023-09-01)