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Data Mining in Drug Discovery [2013]

1
Protein Structural Databases in Drug Discovery
25
Public Domain Databases for Medicinal Chemistry
55
Chemical Ontologies for Standardization, Knowledge Discovery, and Data Mining
75
Building a Corporate Chemical Database Toward Systems Biology
99
Data Mining of Plant Metabolic Pathways
131
The Role of Data Mining in the Identification of Bioactive Compounds via High‐Throughput Screening
155
The Value of Interactive Visual Analytics in Drug Discovery: An Overview
179
Using Chemoinformatics Tools from R
209
Content Development Strategies for the Successful Implementation of Data Mining Technologies
241
Applications of Rule‐Based Methods to Data Mining of Polypharmacology Data Sets
257
Data Mining Using Ligand Profiling and Target Fishing
271
Data Mining of Large‐Scale Molecular and Organismal Traits Using an Integrative and Modular Analysis Approach
291
Systems Biology Approaches for Compound Testing
317
Index
I
Front Matter
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