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Contents
 
Introduction
Help Videos
Reference Guide
Getting Started
Protein Structure
Molecular Graphics
Slides & ActiveICM
Sequences & Alignments
Protein Modeling
Cheminformatics
 Read
 Save
 Chemical Spreadsheets
 Editor
 Chemical Search
 2D Interaction
 Convert to 3D
 Fragments
 Find Bioisostere
 Molcart
 Calculate Properties
 Standardize Table
 Annotate
 Align/Color by 2D Scaffold
 Formal Charges
 Torsion Analysis
 Enumerate Formal Charge States
 Protonation vs pH
 Convert
 Build Prediction Model
 Predict
 Generate 3D Conformers
 Generate Tautomers
 Generate Stereoisomers
 Prodrug
 Ligand Energetics
 Cluster Set
 PCA Analysis
 Visualize Chemical Space
 Compare Two Sets
 Merge Two Sets
 Select Duplicates
 MPO
 Combinatorial Chemistry
 SAR Analysis
 Chemical Superposition
 APF Tools
Learn and Predict
Docking
Virtual Screening
Molecular Dynamics
MolScreen
3D Ligand Editor
Tables and Plots
Local Databases
ICM-Scarab
KNIME
Tutorials
FAQs
 
Index
PrevICM User's Guide
10.20 Build Prediction Model		Next
Available in the following product(s): ICM-Chemist-Pro | ICM-VLS

Structure-Activity Relationship (SAR) is a process by which the activity of a molecule is related to its molecular structure. If a significant ammount of structural and activity data is available a model can be made which can be used to predict the activity of a molecule or series of molecules.

In ICM SAR is undertaken using the Learn and Predict tools in a Molecular Table.

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