ZDOCK: an initial‐stage protein‐docking algorithm

R Chen, L Li, Z Weng - Proteins: Structure, Function, and …, 2003 - Wiley Online Library
The development of scoring functions is of great importance to protein docking. Here we
present a new scoring function for the initial stage of unbound docking. It combines our …

RDOCK: refinement of rigid‐body protein docking predictions

L Li, R Chen, Z Weng - Proteins: Structure, Function, and …, 2003 - Wiley Online Library
We present a simple and effective algorithm RDOCK for refining unbound predictions
generated by a rigid‐body docking algorithm ZDOCK, which has been developed earlier by …

ZDOCK predictions for the CAPRI challenge

R Chen, W Tong, J Mintseris, L Li… - … : Structure, Function, and …, 2003 - Wiley Online Library
The CAPRI Challenge is a blind test of protein–protein‐docking algorithms that predict the
complex structure from the crystal structures of the interacting proteins. We participated in …

Identification of near‐native structures by clustering protein docking conformations

S Lorenzen, Y Zhang - PROTEINS: Structure, Function, and …, 2007 - Wiley Online Library
Most state‐of‐the‐art protein–protein docking algorithms use the Fast Fourier Transform
(FFT) technique to sample the six‐dimensional translational and rotational space. Scoring …

ZRANK: reranking protein docking predictions with an optimized energy function

B Pierce, Z Weng - Proteins: Structure, Function, and …, 2007 - Wiley Online Library
Protein–protein docking requires fast and effective methods to quickly discriminate correct
from incorrect predictions generated by initial‐stage docking. We have developed and …

pyDock: Electrostatics and desolvation for effective scoring of rigid‐body protein–protein docking

TMK Cheng, TL Blundell… - … Structure, Function, and …, 2007 - Wiley Online Library
The accurate scoring of rigid‐body docking orientations represents one of the major
difficulties in protein–protein docking prediction. Other challenges are the development of …

FireDock: fast interaction refinement in molecular docking

N Andrusier, R Nussinov… - … : Structure, Function, and …, 2007 - Wiley Online Library
Here, we present FireDock, an efficient method for the refinement and rescoring of rigid‐
body docking solutions. The refinement process consists of two main steps:(1) …

Integrating atom‐based and residue‐based scoring functions for protein–protein docking

T Vreven, H Hwang, Z Weng - Protein Science, 2011 - Wiley Online Library
Most scoring functions for protein–protein docking algorithms are either atom‐based or
residue‐based, with the former being able to produce higher quality structures and latter …

A combination of rescoring and refinement significantly improves protein docking performance

B Pierce, Z Weng - Proteins: Structure, Function, and …, 2008 - Wiley Online Library
To determine the structures of protein–protein interactions, protein docking is a valuable tool
that complements experimental methods to characterize protein complexes. Although …

Protein–protein docking benchmark version 3.0

H Hwang, B Pierce, J Mintseris… - Proteins: Structure …, 2008 - Wiley Online Library
We present version 3.0 of our publicly available protein–protein docking benchmark. This
update includes 40 new test cases, representing a 48% increase from Benchmark 2.0. For …