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Method and means for synthesis-based simulation of chemicals having biological functions

Patent 5862514 Issued on January 19, 1999. Estimated Expiration Date: Icon_subject December 6, 2016. Estimated Expiration Date is calculated based on simple USPTO term provisions. It does not account for terminal disclaimers, term adjustments, failure to pay maintenance fees, or other factors which might affect the term of a patent.

Patent References

System and method of automatically generating chemical compounds with desired properties Patent #: 5463564
Issued on: 10/31/1995
Inventor: Agrafiotis, et al.

Inventors

Application

No. 758741 filed on 12/06/1996

US Classes:

702/22, Chemical analysis528/1, FROM PLANT MATERIAL OF UNKNOWN CONSTITUTION702/19Biological or biochemical

Examiners

Primary: Kemmerer, Elizabeth
Assistant: Basi, Nirmal S.

Attorney, Agent or Firm

International Classes

G06F 019/00
G06F 017/00

Abstract

This invention provides a computer-executed method and means for simulating chemical synthesis. The invention concerns the simulation, by a programmed general purpose digital computer, of chemicals that have biological functions, and more specifically, concerns computer-implemented simulation of such chemicals based upon their synthesis and their assayed biological activity.

Other References

  • Foundations of Quantum Mechanics I, Ludwig, G., Springer-Verlag, New York, pp. 32-40, 1983
  • Hendrickson, et al., The Syngen approach to synthesis design Analytica Chemica Acta v.1235, pp. 103-113, 199
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