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» A New Approach to Protein Structure Mining and Alignment
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ICML
2007
IEEE
14 years 9 months ago
An integrated approach to feature invention and model construction for drug activity prediction
We present a new machine learning approach for 3D-QSAR, the task of predicting binding affinities of molecules to target proteins based on 3D structure. Our approach predicts bind...
David Page, Jesse Davis, Soumya Ray, Vítor ...
ALGORITHMICA
1999
84views more  ALGORITHMICA 1999»
13 years 8 months ago
Computational Approaches to Drug Design
Abstract. The rational approach to pharmaceutical drug design begins with an investigation of the relationship between chemical structure and biological activity. Information gaine...
Paul W. Finn, Lydia E. Kavraki
ICPP
2006
IEEE
14 years 2 months ago
A Parallel, Out-of-Core Algorithm for RNA Secondary Structure Prediction
RNA pseudoknot prediction is an algorithm for RNA sequence search and alignment. An important building block towards pseudoknot prediction is RNA secondary structure prediction. T...
Wenduo Zhou, David K. Lowenthal
BPM
2007
Springer
155views Business» more  BPM 2007»
14 years 14 days ago
Fuzzy Mining - Adaptive Process Simplification Based on Multi-perspective Metrics
Abstract. Process Mining is a technique for extracting process models from execution logs. This is particularly useful in situations where people have an idealized view of reality....
Christian W. Günther, Wil M. P. van der Aalst
BMCBI
2007
105views more  BMCBI 2007»
13 years 8 months ago
Generating confidence intervals on biological networks
Background: In the analysis of networks we frequently require the statistical significance of some network statistic, such as measures of similarity for the properties of interact...
Thomas Thorne, Michael P. H. Stumpf