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AB
2008
Springer
13 years 11 months ago
The Smallest Multistationary Mass-Preserving Chemical Reaction Network
Biochemical models that exhibit bistability are of interest to biologists and mathematicians alike. Chemical reaction network theory can provide sufficient conditions for the exist...
Anne Shiu
KDD
2008
ACM
121views Data Mining» more  KDD 2008»
14 years 5 months ago
Reconstructing chemical reaction networks: data mining meets system identification
We present an approach to reconstructing chemical reaction networks from time series measurements of the concentrations of the molecules involved. Our solution strategy combines t...
Yong Ju Cho, Naren Ramakrishnan, Yang Cao
ECAL
2007
Springer
13 years 11 months ago
Catalysis by Self-Assembled Structures in Emergent Reaction Networks
We introduce a new variant of the dissipative particle dynamics (DPD) model that includes the possibility of dynamically forming and breaking strong bonds. The emergent reaction ki...
Gianluca Gazzola, Andrew Buchanan, Norman H. Packa...
CANDC
1999
ACM
13 years 5 months ago
The Kinetic Evolutionary Modeling of Complex Systems of Chemical Reactions
Hongqing Cao, Jingxian Yu, Lishan Kang, Yuping Che...
ICCSA
2004
Springer
13 years 10 months ago
Molecular Simulation of Reaction and Adsorption in Nanochemical Devices: Increase of Reaction Conversion by Separation of a Prod
We present a novel simulation tool to study fluid mixtures that are simultaneously chemically reacting and adsorbing within a molecularly porous material. The method is a combinat...
William R. Smith, Martin Lísal