Search Results - "Tissen, Jos"

Melting Point Prediction Employing k-Nearest Neighbor Algorithms and Genetic Parameter Optimization by Nigsch, Florian, Bender, Andreas, van Buuren, Bernd, Tissen, Jos, Nigsch, Eduard, Mitchell, John B. O

“…We have applied the k-nearest neighbor (kNN) modeling technique to the prediction of melting points. A data set of 4119 diverse organic molecules (data set 1)…”
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Iterated Reaction Graphs:  Simulating Complex Maillard Reaction Pathways by Patel, Shail, Rabone, Jeremy, Russell, Stephen, Tissen, Jos, Klaffke, Werner

“…This study investigates a new method of simulating a complex chemical system including feedback loops and parallel reactions. The practical purpose of this…”
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Iterated reaction graphs: computer simulation of the Maillard volatile compounds by Russell, Stephen, Patel, Shail, Rabone, Jeremy, Tissen, Jos, Klaffke, Werner

“…The work describes a new method of simulating the chemical reactions in a complex chemical system so as to predict the products actually formed. Using the…”
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