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BIOCOMP
2006
14 years 11 months ago
Combined QM/MM Studies of Binding Effect of Cytochrome P450cam to Putidaredoxin
Abstract - Combined QM/MM calculations of an activesite of Cytochrome P450cam have been performed, before and after a binding process of Cytochrome P450cam to Putidaredoxin. The ca...
Marek Freindorf, Yihan Shao, Jing Kong, Thomas R. ...
BIOCOMP
2006
14 years 11 months ago
WebDock: A Structure-Based Drug Discovery Web Service
High-Throughput Docking has emerged as a well establish method for identifying lead components in the process of searching for new drugs. The High-Throughput Docking Service provi...
Joseph Gill, Legand L. Burge III, Zengjian Hu, Wil...
BIOCOMP
2006
14 years 11 months ago
Structure-Based Design and Analysis of Cytochrome P450 Inhibitors for the Treatment of Prostate Cancer
- Structure-based drug design approach is used to design and analyze cytochrome P450 inhibitors for the treatment of prostate cancer. The structural efficiency of inhibitors is mea...
Muhittin Emre Ozdemir, I. Halil Kavakli, Metin T&u...
BIOCOMP
2006
14 years 11 months ago
Theoretical Bounds for the Number of Inferable Edges in Sparse Random Networks
Abstract-- The inference of a network structure from experimental data providing dynamical information about the underlying system of investigation is an important and still outsta...
Frank Emmert-Streib, Matthias Dehmer
BIOCOMP
2006
14 years 11 months ago
A Heuristic Approach to Scoring Gene Clustering Algorithms
In the past decades, many clustering algorithms have been proposed for the analysis of gene expression data, but little guidance is available to help choose among them. Given the ...
Longde Yin, Chun-Hsi Huang