10.5281/zenodo.2526083
https://zenodo.org/records/2526083
oai:zenodo.org:2526083
M. Venkata Saileela1*, Dr. M. Venkateswar Rao2, Venkata Rao Vutla1
M. Venkata Saileela1*, Dr. M. Venkateswar Rao2, Venkata Rao Vutla1
1Department of Pharmaceutical Analysis, Chalapathi Institute of Pharmaceutical Sciences, Lam, Guntur. 2Department of Pharmacology, Guntur Medical College, Guntur.
A REVIEW ON APPLICATIONS OF MOLECULAR DOCKING IN DRUG DESIGNING
Zenodo
2017
Molecular Modelling, Scoring Functions.
2017-04-30
10.5281/zenodo.2526082
https://zenodo.org/communities/iajpr
Creative Commons Attribution 4.0 International
Molecular docking is a computational modelling of structure of complexes formed by two or more interacting molecules. In the field of molecular modelling, docking is a method which predicts the preferred orientation of one molecule to a second when bound to each other to form a stable complex. Knowledge of the preferred orientation in turn may be used to predict the strength of association or binding affinity between two molecules using scoring functions. Molecular docking is one of the most frequently used in structure based drug design due to its ability to predict the binding-conformation of small molecules ligands to the appropriate target binding site.