Wednesday, October 13, 2010

CHEMSKETCH

ACD/ChemSketch is a chemically intelligent drawing interface that allows 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
Benefits
  • Visualize chemical structures in 2D or 3D to gain more insight into spatial configurations, and relationships to molecular properties
  • Create professional reports, working with structures, text, and graphics simultaneously
ACD/ChemSketch also allows to check other tautomeric forms for your drawn structure. Consideration of tautomeric forms is very important for structure searching, predictions (such as physicochemical properties, i.e., pKa), and interpretation (i.e., of NMR, MS, and other analytical data). 

 

Above picture is what i have done using the manual of CHEMSKETCH


That's All....... THANK YOU...........

KOS1110 COMPUTER IN SCIENCE
TIME 2.00PM - 5.00PM
VENUE ORKID LAB

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