AU2001241433A1 - Methods for predicting the biological, chemical, and physical properties of molecules from their spectral properties - Google Patents

Methods for predicting the biological, chemical, and physical properties of molecules from their spectral properties

Info

Publication number
AU2001241433A1
AU2001241433A1 AU2001241433A AU4143301A AU2001241433A1 AU 2001241433 A1 AU2001241433 A1 AU 2001241433A1 AU 2001241433 A AU2001241433 A AU 2001241433A AU 4143301 A AU4143301 A AU 4143301A AU 2001241433 A1 AU2001241433 A1 AU 2001241433A1
Authority
AU
Australia
Prior art keywords
predicting
molecules
biological
chemical
methods
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.)
Abandoned
Application number
AU2001241433A
Inventor
Richard Beger
James P. Freeman
Jackson O. Lay Jr.
Dwight W. Miller
Jon G. Wilkens
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.)
US Department of Health and Human Services
Original Assignee
US Department of Health and Human Services
US Government
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
Priority claimed from US09/629,557 external-priority patent/US6898533B1/en
Application filed by US Department of Health and Human Services, US Government filed Critical US Department of Health and Human Services
Publication of AU2001241433A1 publication Critical patent/AU2001241433A1/en
Abandoned legal-status Critical Current

Links

Classifications

    • H—ELECTRICITY
    • H01—ELECTRIC ELEMENTS
    • H01J—ELECTRIC DISCHARGE TUBES OR DISCHARGE LAMPS
    • H01J49/00—Particle spectrometers or separator tubes
    • H01J49/0027—Methods for using particle spectrometers
    • H01J49/0036—Step by step routines describing the handling of the data generated during a measurement
    • G—PHYSICS
    • G01—MEASURING; TESTING
    • G01N—INVESTIGATING OR ANALYSING MATERIALS BY DETERMINING THEIR CHEMICAL OR PHYSICAL PROPERTIES
    • G01N21/00—Investigating or analysing materials by the use of optical means, i.e. using sub-millimetre waves, infrared, visible or ultraviolet light
    • G01N21/17—Systems in which incident light is modified in accordance with the properties of the material investigated
    • G01N21/25—Colour; Spectral properties, i.e. comparison of effect of material on the light at two or more different wavelengths or wavelength bands
AU2001241433A 2000-02-01 2001-01-31 Methods for predicting the biological, chemical, and physical properties of molecules from their spectral properties Abandoned AU2001241433A1 (en)

Applications Claiming Priority (5)

Application Number Priority Date Filing Date Title
US49631400A 2000-02-01 2000-02-01
US09/496,314 2000-02-01
US09/629,557 US6898533B1 (en) 2000-02-01 2000-07-31 Methods for predicting the biological, chemical, and physical properties of molecules from their spectral properties
US09/629,557 2000-07-31
PCT/US2001/003142 WO2001057495A2 (en) 2000-02-01 2001-01-31 Methods for predicting the biological, chemical, and physical properties of molecules from their spectral properties

Publications (1)

Publication Number Publication Date
AU2001241433A1 true AU2001241433A1 (en) 2001-08-14

Family

ID=27052063

Family Applications (1)

Application Number Title Priority Date Filing Date
AU2001241433A Abandoned AU2001241433A1 (en) 2000-02-01 2001-01-31 Methods for predicting the biological, chemical, and physical properties of molecules from their spectral properties

Country Status (4)

Country Link
US (1) US20040220749A1 (en)
AU (1) AU2001241433A1 (en)
CA (1) CA2399967A1 (en)
WO (1) WO2001057495A2 (en)

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US7996156B2 (en) 2002-03-07 2011-08-09 The United States Of America As Represented By The Secretary, Department Of Health And Human Services Methods for predicting properties of molecules
JP2008536144A (en) * 2005-04-15 2008-09-04 ケミマジ コーポレーション Method and apparatus for spectral analysis of mixtures
US8112233B2 (en) * 2005-07-21 2012-02-07 The Invention Science Fund I, Llc Selective resonance of chemical structures
US9211332B2 (en) * 2005-07-21 2015-12-15 The Invention Science Fund I, Llc Selective resonance of bodily agents
US20070021924A1 (en) * 2005-07-21 2007-01-25 Ishikawa Muriel Y Selective resonance of chemical structures
US9427465B2 (en) * 2005-07-21 2016-08-30 Deep Science, Llc Selective resonance of chemical structures
SG141319A1 (en) * 2006-09-08 2008-04-28 Hoffmann La Roche Method for predicting biological, biochemical, biophysical, or pharmacological characteristics of a substance
US8647272B2 (en) * 2007-06-21 2014-02-11 Rf Science & Technology Inc Non-invasive scanning apparatuses
US8382668B2 (en) 2007-06-21 2013-02-26 Rf Science & Technology Inc. Non-invasive determination of characteristics of a sample
US10264993B2 (en) * 2007-06-21 2019-04-23 Rf Science & Technology Inc. Sample scanning and analysis system and methods for using the same
US8647273B2 (en) * 2007-06-21 2014-02-11 RF Science & Technology, Inc. Non-invasive weight and performance management
US20090192741A1 (en) * 2008-01-30 2009-07-30 Mensur Omerbashich Method for measuring field dynamics
EP2270530B1 (en) * 2009-07-01 2013-05-01 Københavns Universitet Method for prediction of lipoprotein content from NMR data
US8880354B2 (en) * 2009-11-13 2014-11-04 The United States Of America, As Represented By The Secretary, Department Of Health And Human Services System for magnetic resonance spectroscopy of brain tissue for pattern-based diagnostics
US8524239B2 (en) 2010-07-09 2013-09-03 The United States of America as represented by the Secrectary, Department of Health and Human Services Photosensitizing antibody-fluorophore conjugates
FR2973880B1 (en) * 2011-04-06 2013-05-17 Commissariat Energie Atomique METHOD AND DEVICE FOR ESTIMATING BIOLOGICAL OR CHEMICAL PARAMETERS IN A SAMPLE, METHOD FOR ASSISTING THE DIAGNOSIS THEREFOR
JP2013122443A (en) * 2011-11-11 2013-06-20 Hideo Ando Biological activity measuring method, biological activity measuring device, method for transfer of biological activity detection signal and method for provision of service using biological activity information
JP2014239871A (en) 2013-05-07 2014-12-25 安東　秀夫 Biological activity detection method, biological activity measuring apparatus, biological activity detection signal transfer method, and providing method of service using biological activity information
WO2014204990A2 (en) * 2013-06-18 2014-12-24 The George Washington University, A Congressionally Chartered Not-For-Profit Corporation Methods of predicting of chemical properties from spectroscopic data
DE102014009154A1 (en) * 2014-06-25 2015-12-31 Alnumed Gmbh Method for classifying a substance mixture
JP6796058B2 (en) 2014-08-08 2020-12-02 ザ ユナイテッド ステイツ オブ アメリカ， アズ リプレゼンテッド バイ ザ セクレタリー， デパートメント オブ ヘルス アンド ヒューマン サービシーズ Light-controlled removal of targets in vitro and in vivo
WO2017027247A1 (en) 2015-08-07 2017-02-16 The United States Of America, As Represented By The Secretary, Department Of Health And Human Services Near infrared photoimmunotherapy (nir-pit) of suppressor cells to treat cancer
CA2994871A1 (en) 2015-08-18 2017-02-23 Aspyrian Therapeutics, Inc. Phthalocyanine dye conjugates and their storage
EP3337514B8 (en) 2015-08-18 2022-04-06 Rakuten Medical, Inc. Composition comprising a conjugate comprising a phthalocyanine dye linked to a targeting molecule for photoimmunotherapy
US10366779B2 (en) * 2015-12-30 2019-07-30 International Business Machines Corporation Scheme of new materials
US10622098B2 (en) 2017-09-12 2020-04-14 Massachusetts Institute Of Technology Systems and methods for predicting chemical reactions
CN112683816B (en) * 2020-12-25 2021-08-06 中船重工安谱（湖北）仪器有限公司 Spectrum identification method for spectrum model transmission
CN112816453B (en) * 2021-02-09 2022-07-08 黑龙江大学 Use of proteins for predicting drug performance
WO2024005068A1 (en) * 2022-06-30 2024-01-04 コニカミノルタ株式会社 Prediction device, prediction system, and prediction program
CN115177615A (en) * 2022-08-04 2022-10-14 湖南中医药大学 Application of psoralen in estrogen-promoting medicine

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Publication number Priority date Publication date Assignee Title
US5121338A (en) * 1988-03-10 1992-06-09 Indiana University Foundation Method for detecting subpopulations in spectral analysis
US5025388A (en) * 1988-08-26 1991-06-18 Cramer Richard D Iii Comparative molecular field analysis (CoMFA)
CA2025330C (en) * 1989-09-18 2002-01-22 David W. Osten Characterizing biological matter in a dynamic condition using near infrared spectroscopy
US5218529A (en) * 1990-07-30 1993-06-08 University Of Georgia Research Foundation, Inc. Neural network system and methods for analysis of organic materials and structures using spectral data
JPH1048157A (en) * 1996-08-08 1998-02-20 Toray Ind Inc Apparatus for measuring and analyzing with simulation of molecule and method for analyzing chemical structure of substance
US5751605A (en) * 1996-08-15 1998-05-12 Tripos, Inc. Molecular hologram QSAR
GB9803466D0 (en) * 1998-02-19 1998-04-15 Chemical Computing Group Inc Discrete QSAR:a machine to determine structure activity and relationships for high throughput screening
US6821402B1 (en) * 1998-09-16 2004-11-23 Applera Corporation Spectral calibration of fluorescent polynucleotide separation apparatus
US6898533B1 (en) * 2000-02-01 2005-05-24 The United States Of America As Represented By The Department Of Health And Human Services Methods for predicting the biological, chemical, and physical properties of molecules from their spectral properties

Also Published As

Publication number Publication date
WO2001057495A9 (en) 2002-10-31
US20040220749A1 (en) 2004-11-04
WO2001057495A3 (en) 2002-03-14
CA2399967A1 (en) 2001-08-09
WO2001057495A2 (en) 2001-08-09

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