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BMCBI
2005
156views more  BMCBI 2005»
15 years 4 months ago
A new dynamical layout algorithm for complex biochemical reaction networks
Background: To study complex biochemical reaction networks in living cells researchers more and more rely on databases and computational methods. In order to facilitate computatio...
Katja Wegner, Ursula Kummer
BMCBI
2005
86views more  BMCBI 2005»
15 years 4 months ago
WebArray: an online platform for microarray data analysis
Background: Many cutting-edge microarray analysis tools and algorithms, including commonly used limma and affy packages in Bioconductor, need sophisticated knowledge of mathematic...
Xiaoqin Xia, Michael McClelland, Yipeng Wang
JCC
2007
79views more  JCC 2007»
15 years 4 months ago
Interfacing Q-Chem and CHARMM to perform QM/MM reaction path calculations
Abstract: A hybrid quantum mechanical/molecular mechanical (QM/MM) potential energy function with HartreeFock, density functional theory (DFT), and post-HF (RIMP2, MP2, CCSD) capab...
H. Lee Woodcock III, Milan Hodoscek, Andrew T. B. ...
JCP
2007
108views more  JCP 2007»
15 years 4 months ago
A Genetic Algorithm Method to Assimilate Sensor Data for a Toxic Contaminant Release
— Following a toxic contaminant release, either accidental or intentional, predicting the transport and dispersion of the contaminant becomes a critical problem for Homeland Defe...
Sue Ellen Haupt, George S. Young, Christopher T. A...
CAD
2005
Springer
15 years 4 months ago
Frontal geometry from sketches of engineering objects: is line labelling necessary?
A tool which can quickly interpret line drawings (with hidden lines removed) of engineering objects as boundary representation CAD models would be of significant benefit in the pr...
P. A. C. Varley, Ralph R. Martin, Hiromasa Suzuki
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