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Leadscope Hosted

 Demonstration
Collaborative solution with no server hardware or maintenance required
Intuitively access chemical analysis and visualization
Exhaustively, yet rapidly uncover patterns and outliers
Description Access Leadscope solutions from a remotely hosted server
Features
  • Access to extensive databases (such as the Leadscope® Toxicity Database) from a remotely hosted server
  • Load up to 250,000 compounds with associated data either on the server
  • Different ways of grouping sets of chemical structures including:
    • A classification based on over 27,000 medicinal chemistry building blocks
    • Recursive partitioning with simulated annealing (a technique for identifying active classes)
    • Structure-based clustering
    • Scaffolding
  • Subsetting methods
  • User-defined alerts
  • Structure-based searching (such as substructure or similarity)
  • Colored graphical views of correlations
  • Calculates properties (for example aLogP, polar surface area and Lipinski scores)
  • 250,000 compound capability
Requirements
  • Windows 2000 or XP
  • minimum Pentium III 700MHz processor
  • 512 MB RAM
  • 1 GB disk space
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