Tuesday, October 12, 2010

CHEMSKETCH

ACD/ChemSketch is a chemically intelligent drawing interface that allows you to draw almost any chemical structure including organics, organometallics, polymers, and Markush structures. Use it to produce professional looking structures and diagrams for reports and publications. 

Features
  • Draw and view structures in 2D, or render in 3D to view from any angle
  • Draw reactions and reaction schemes, and calculate reactant quantities
  • Generate structures from InChI and SMILES strings
  • Generate IUPAC systematic names for molecules of up to 50 atoms and 3 ring structures
  • Predict logP for individual structures
  • Search for structures in the built-in dictionary of over 165,000 systematic, trivial, and trade names
To download the ACD/Chemsketch software click here

To learn how to use the chemsketch , you can click here 

Below is the exercise that i have done in class:

exercise 1

exercise 2

exercise 3

exercise 4

exercise 5

Input/Output Formats

The ACD/ChemSketch interface, when coupled with the ACD?ChemBasic set of tools, provides a wide array of supported formats.


Format NameFile ExtensionComment
ACD/Labs Structure*.sk2ACD/Labs standard format for structures and reports
Adobe Acrobat*.pdfAdobe portable document format (PDF)
MDL molfile*.molIndustry standard for molecular structures
ChemDraw*.chmChemDraw version 4.0 & earlier, from CambridgeSoft
ChemDraw*.cdxChemDraw version 4.0 & later, from CambridgeSoft
SMILESGenerates Structure from SMILES or SMILES from structure



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