Berichte des Symposiums "Chemical Data Analysis in the Large: The Challenge of the Automation Age"



22. - 26. Mai 2000, Bozen, Italien


Preface
Full Text   PDF
 

Web Search, Filtering, and Text Mining: Technology for a New  Era of Information Access
Bruce Croft
Full Text   PDF


Information Extraction from Biological Science Journal Articles: Enzyme Interactions and Protein Structures
Robert Gaizauskas, Kevin Humphreys and George Demetriou
Full Text   PDF


Designing Combinatorial Libraries by Exploring Drug Space
Valerie J. Gillet
Full Text   PDF
 

Clustering in Massive Data Sets
Fionn Murtagh
Full Text   PDF
 

Model-Based Data Compression: From Data Compression to Information Condensation
Holger Wallmeier
Full Text   PDF


Structural  Browsing  Indices  as  High-Throughput SAR Analysis Tools
Mark Johnson and Yong-Jin Xu
Full Text   PDF

Computation and Analysis of Large Chemistry Data Sets 
S. Stanley Young and Chris E. Keefer
Full Text   PDF


Prediction of Pharmaceutically Important Properties from Monte Carlo Simulations
William L. Jorgensen and Erin M. Duffy
Full Text   PDF


Quantum Cheminformatics:  An  Oxymoron?
Timothy Clark
Full Text   PDF


Mobile  Electrons  in  Molecules:  The Anisotropy of the Current-Induced Density (ACID)
Rainer Herges and Andrea Papafilippopoulos
Full Text   PDF


Visualisation and Integrated Data Mining of Disparate Information
Jefferey D. Saffer, Cory L. Albright, Augustin J. Calapristi, Guang Chen, Vernon L. Crow, Scott D. Decker, Kevin M. Groch, Susan L. Havre, Joel M. Malard, Tonya J. Martin, Nancy E. Miller, Philip J. Monroe, Lucy T. Nowell, Deborah A. Payne, Jorge F. Reyes Spindola, Randall E. Scarberry, Heidi J. Sofia, Lisa C. Stillwell, Gregory S. Thomas, Sarah J. Thurston, Leigh K. Williams and Sean J. Zabriskie
Full Text   PDF