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JCC
2007
79views more  JCC 2007»
13 years 10 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. ...
COLCOM
2007
IEEE
14 years 5 months ago
Peer2Schedule - an experimental peer-to-peer application to support present collaboration
Abstract—This paper describes experiences from implementing an experimental mobile peer-to-peer application called Peer2Schedule aimed at improving and supporting collaboration w...
Alf Inge Wang, Peter Nicolai Motzfeldt
CONCUR
2007
Springer
14 years 5 months ago
Rule-Based Modelling of Cellular Signalling
Abstract. Modelling is becoming a necessity in studying biological signalling pathways, because the combinatorial complexity of such systems rapidly overwhelms intuitive and qualit...
Vincent Danos, Jérôme Feret, Walter F...
DCOSS
2007
Springer
14 years 5 months ago
Separating the Wheat from the Chaff: Practical Anomaly Detection Schemes in Ecological Applications of Distributed Sensor Networ
Abstract. We develop a practical, distributed algorithm to detect events, identify measurement errors, and infer missing readings in ecological applications of wireless sensor netw...
Luís M. A. Bettencourt, Aric A. Hagberg, Le...
PPAM
2007
Springer
14 years 5 months ago
A Cost-Benefit-Based Adaptation Scheme for Multimeme Algorithms
Abstract. Memetic Algorithms are the most frequently used hybrid of Evolutionary Algorithms (EA) for real-world applications. This paper will deal with one of the most important ob...
Wilfried Jakob