MDock Server

Introduction

MDock Server is an inverse virtual screening engine to predict the most likely target in our protein database.

Inverse Virtual Screening

Protein category:
All

Ligand structure: (mol2 format is required)

Job name :

Email address: (to which the prediction result will be sent)

Do not show my job on the queue page

Please cite the following references for MDock:

1. Ma, Z., Xu, X. and Zou, X. MDockServer: an efficient docking platform for inverse virtual screening. (to be submitted)


2. Yan C, and Zou, X., 2016. MDock: An ensemble docking suite for molecular docking, scoring and in silico screening. In Zhang, W. (ed.), Computer-Aided Drug Discovery. Methods in Pharmacology and Toxicology. Humana Press, New York NY, pp.153-166.


3. Huang, S.Y. and Zou, X., 2007. Ensemble docking of multiple protein structures: considering protein structural variations in molecular docking. Proteins: Structure, Function, and Bioinformatics, 66(2), pp.399-421.