DE69424427D1 - Verfahren zum entwerfen von molekülen mit gesuchten eigenschaften bei aufeinanderfolgender populationsentwicklung - Google Patents

Verfahren zum entwerfen von molekülen mit gesuchten eigenschaften bei aufeinanderfolgender populationsentwicklung

Info

Publication number
DE69424427D1
DE69424427D1 DE69424427T DE69424427T DE69424427D1 DE 69424427 D1 DE69424427 D1 DE 69424427D1 DE 69424427 T DE69424427 T DE 69424427T DE 69424427 T DE69424427 T DE 69424427T DE 69424427 D1 DE69424427 D1 DE 69424427D1
Authority
DE
Germany
Prior art keywords
population
fitness
molecules
properties
evolved
Prior art date
Legal status (The legal status is an assumption and is not a legal conclusion. Google has not performed a legal analysis and makes no representation as to the accuracy of the status listed.)
Expired - Lifetime
Application number
DE69424427T
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English (en)
Other versions
DE69424427T2 (de
Inventor
David Weininger
Current Assignee (The listed assignees may be inaccurate. Google has not performed a legal analysis and makes no representation or warranty as to the accuracy of the list.)
Daylight Chemical Information Systems Inc
Original Assignee
Daylight Chemical Information Systems Inc
Priority date (The priority date is an assumption and is not a legal conclusion. Google has not performed a legal analysis and makes no representation as to the accuracy of the date listed.)
Filing date
Publication date
Application filed by Daylight Chemical Information Systems Inc filed Critical Daylight Chemical Information Systems Inc
Publication of DE69424427D1 publication Critical patent/DE69424427D1/de
Application granted granted Critical
Publication of DE69424427T2 publication Critical patent/DE69424427T2/de
Anticipated expiration legal-status Critical
Expired - Lifetime legal-status Critical Current

Links

Classifications

    • C—CHEMISTRY; METALLURGY
    • C07—ORGANIC CHEMISTRY
    • C07K—PEPTIDES
    • C07K1/00—General methods for the preparation of peptides, i.e. processes for the organic chemical preparation of peptides or proteins of any length
    • C07K1/04—General methods for the preparation of peptides, i.e. processes for the organic chemical preparation of peptides or proteins of any length on carriers
    • C07K1/047—Simultaneous synthesis of different peptide species; Peptide libraries
    • B—PERFORMING OPERATIONS; TRANSPORTING
    • B01—PHYSICAL OR CHEMICAL PROCESSES OR APPARATUS IN GENERAL
    • B01J—CHEMICAL OR PHYSICAL PROCESSES, e.g. CATALYSIS OR COLLOID CHEMISTRY; THEIR RELEVANT APPARATUS
    • B01J19/00—Chemical, physical or physico-chemical processes in general; Their relevant apparatus
    • B01J19/0046—Sequential or parallel reactions, e.g. for the synthesis of polypeptides or polynucleotides; Apparatus and devices for combinatorial chemistry or for making molecular arrays
    • C—CHEMISTRY; METALLURGY
    • C07—ORGANIC CHEMISTRY
    • C07K—PEPTIDES
    • C07K1/00—General methods for the preparation of peptides, i.e. processes for the organic chemical preparation of peptides or proteins of any length
    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
    • G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
    • G16C20/50—Molecular design, e.g. of drugs
    • B—PERFORMING OPERATIONS; TRANSPORTING
    • B01—PHYSICAL OR CHEMICAL PROCESSES OR APPARATUS IN GENERAL
    • B01J—CHEMICAL OR PHYSICAL PROCESSES, e.g. CATALYSIS OR COLLOID CHEMISTRY; THEIR RELEVANT APPARATUS
    • B01J2219/00—Chemical, physical or physico-chemical processes in general; Their relevant apparatus
    • B01J2219/00274—Sequential or parallel reactions; Apparatus and devices for combinatorial chemistry or for making arrays; Chemical library technology
    • B01J2219/0068—Means for controlling the apparatus of the process
    • B01J2219/007—Simulation or vitual synthesis
    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
    • G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
    • G16C20/70—Machine learning, data mining or chemometrics
DE69424427T 1993-06-30 1994-06-29 Verfahren zum entwerfen von molekülen mit gesuchten eigenschaften bei aufeinanderfolgender populationsentwicklung Expired - Lifetime DE69424427T2 (de)

Applications Claiming Priority (2)

Application Number Priority Date Filing Date Title
US08/084,361 US5434796A (en) 1993-06-30 1993-06-30 Method and apparatus for designing molecules with desired properties by evolving successive populations
PCT/US1994/007453 WO1995001606A1 (en) 1993-06-30 1994-06-29 Method and apparatus for designing molecules with desired properties by evolving successive populations

Publications (2)

Publication Number Publication Date
DE69424427D1 true DE69424427D1 (de) 2000-06-15
DE69424427T2 DE69424427T2 (de) 2000-10-19

Family

ID=22184475

Family Applications (1)

Application Number Title Priority Date Filing Date
DE69424427T Expired - Lifetime DE69424427T2 (de) 1993-06-30 1994-06-29 Verfahren zum entwerfen von molekülen mit gesuchten eigenschaften bei aufeinanderfolgender populationsentwicklung

Country Status (9)

Country Link
US (1) US5434796A (de)
EP (1) EP0708943B1 (de)
JP (1) JPH08512159A (de)
AT (1) ATE192863T1 (de)
CA (1) CA2166397C (de)
DE (1) DE69424427T2 (de)
DK (1) DK0708943T3 (de)
ES (1) ES2146653T3 (de)
WO (1) WO1995001606A1 (de)

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ATE192863T1 (de) 2000-05-15
EP0708943A4 (de) 1996-09-25
WO1995001606A1 (en) 1995-01-12
CA2166397A1 (en) 1995-01-12
ES2146653T3 (es) 2000-08-16
JPH08512159A (ja) 1996-12-17
EP0708943A1 (de) 1996-05-01
US5434796A (en) 1995-07-18
DE69424427T2 (de) 2000-10-19
CA2166397C (en) 2000-03-21
EP0708943B1 (de) 2000-05-10
DK0708943T3 (da) 2000-10-02

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