DOI: 10.1021/ci0499469. Development of QSAR Models To Predict and Interpret the Biological Activity of Artemisinin Analogues

Development of QSAR Models To Predict and Interpret the Biological Activity of Artemisinin Analogues

10.1021/ci0499469

Crossref journal-article

American Chemical Society (ACS)

Journal of Chemical Information and Computer Sciences (316)

Bibliography

Guha, R., & Jurs, P. C. (2004). Development of QSAR Models To Predict and Interpret the Biological Activity of Artemisinin Analogues. Journal of Chemical Information and Computer Sciences, 44(4), 1440â1449.

Authors 2

Rajarshi Guha (first)
Peter C. Jurs (additional)

References 54 Referenced 45

10.1021/ar950058w / Acc. Chem. Res. by Haynes R. K. (1997)
10.1126/science.3887571 / Science by Klayman D. L. (1985)
{'key': 'ci0499469b00003/ci0499469b00003_1', 'first-page': '592', 'volume': '27', 'author': 'Kamchonwongpaisan S.', 'year': '1996', 'journal-title': 'Gen. Pharmac.'} / Gen. Pharmac. by Kamchonwongpaisan S. (1996)
10.1021/ja00126a042 / J. Am. Chem. Soc. by Posner G. H. (1995)
10.1021/ja954131p / J. Am. Chem. Soc. by Posner G. H. (1996)
10.1039/a827273z / Chem. Soc. Rev. by Robert A. (1998)
{'key': 'ci0499469b00007/ci0499469b00007_1', 'first-page': '132', 'volume': '121', 'author': 'Avery M. A.', 'year': '2000', 'journal-title': 'Biol. Act. Nat. Prod.'} / Biol. Act. Nat. Prod. by Avery M. A. (2000)
10.1023/A:1007967517859 / J. Comput.-Aided Mol. Des. by Woolfrey J. R. (1998)
{'key': 'ci0499469b00009/ci0499469b00009_1', 'first-page': '217', 'volume': '4', 'author': 'Avery M. A.', 'year': '1999', 'journal-title': 'Adv. Med. Chem.'} / Adv. Med. Chem. by Avery M. A. (1999)
{'key': 'ci0499469b00010/ci0499469b00010_1', 'first-page': '303', 'volume': '45', 'author': 'Avery M. A.', 'year': '2002', 'journal-title': 'J. Med. Chem.'} / J. Med. Chem. by Avery M. A. (2002)
{'key': 'ci0499469b00011/ci0499469b00011_1', 'first-page': '409', 'volume': '12', 'author': 'Tommuphean S.', 'year': '1998', 'journal-title': 'J. Comput.-Aided Mol. Des.'} / J. Comput.-Aided Mol. Des. by Tommuphean S. (1998)
10.1021/jm00078a017 / J. Med. Chem. by Avery M. A. (1993)
{'key': 'ci0499469b00013/ci0499469b00013_1', 'first-page': '2891', 'volume': '10', 'author': 'Cheng F.', 'year': '2002', 'journal-title': 'Bioorg. Med. Chem.'} / Bioorg. Med. Chem. by Cheng F. (2002)
10.1021/ci0004558 / J. Chem. Inf. Comput Sci. by Girones X. (2000)
10.1002/1521-3838(200012)19:5<475::AID-QSAR475>3.0.CO;2-3 / Quant. Struct.-Act. Relat. by Tonmunphean S. (2000)
{'key': 'ci0499469b00016/ci0499469b00016_1', 'first-page': '5967', 'volume': '110', 'author': 'Cramer III, R. D.', 'year': '1988', 'journal-title': 'J. Am. Chem. Soc.'} / J. Am. Chem. Soc. by Cramer III, R. D. (1988)
{'key': 'ci0499469b00017/ci0499469b00017_1', 'first-page': '25', 'volume': '7', 'author': 'Cramer III, R. D.', 'year': '1988', 'journal-title': 'Quant. Struct-Act. Relat. Pharmacol., Chem. Biol.'} / Quant. Struct-Act. Relat. Pharmacol., Chem. Biol. by Cramer III, R. D. (1988)
{'key': 'ci0499469b00018/ci0499469b00018_1', 'volume-title': 'Computer Assisted Drug Design', 'author': 'Jurs P. C.', 'year': '1979'} / Computer Assisted Drug Design by Jurs P. C. (1979)
{'key': 'ci0499469b00019/ci0499469b00019_1', 'volume-title': 'Computer Assisted Studies of Chemical Structure and Biological Function', 'author': 'Stuper A. J.', 'year': '1979'} / Computer Assisted Studies of Chemical Structure and Biological Function by Stuper A. J. (1979)
10.1021/jm000244u / J. Med. Chem. by Bakken G. A. (2000)
{'key': 'ci0499469b00021/ci0499469b00021_1', 'first-page': '1560', 'volume': '41', 'author': 'Kauffman G. W.', 'year': '2001', 'journal-title': 'J. Chem. Inf. Comput. Sci.'} / J. Chem. Inf. Comput. Sci. by Kauffman G. W. (2001)
10.1021/ci990125r / J. Chem. Inf. Comput. Sci. by Patankar S. J. (2000)
10.1002/qsar.19930120304 / Quant. Struct.-Act. Relat. by Stanton D. T. (1993)
10.1021/ci034013i / J. Chem. Inf. Comput Sci. by Mattioni B. C. (2003)
10.1016/S1093-3263(02)00187-0 / J. Mol. Graph. Model. by Mattioni B. E. (2003)
Goldstein, H.Classical Mechanics; Addison-Wesley: Reading, MA, 1950.
{'key': 'ci0499469b00027/ci0499469b00027_1', 'volume-title': 'Physical Chemical Properties of Drugs', 'author': 'Pearlman R. S.', 'year': '1980'} / Physical Chemical Properties of Drugs by Pearlman R. S. (1980)
{'key': 'ci0499469b00028/ci0499469b00028_1', 'volume': '64', 'author': 'Kier L. B.', 'year': '1975', 'journal-title': 'J. Pharm. Sci.'} / J. Pharm. Sci. by Kier L. B. (1975)
{'key': 'ci0499469b00029/ci0499469b00029_1', 'first-page': '1809', 'volume': '65', 'author': 'Kier L. B.', 'year': '1976', 'journal-title': 'J. Pharm. Sci.'} / J. Pharm. Sci. by Kier L. B. (1976)
{'key': 'ci0499469b00030/ci0499469b00030_1', 'volume-title': 'Molecular Connectivity in Chemistry and Drug Research', 'author': 'Kier L. B.', 'year': '1976'} / Molecular Connectivity in Chemistry and Drug Research by Kier L. B. (1976)
{'key': 'ci0499469b00031/ci0499469b00031_1', 'volume-title': 'Molecular Connectivity in Structure Activity Analysis', 'author': 'Kier L. B.', 'year': '1986'} / Molecular Connectivity in Structure Activity Analysis by Kier L. B. (1986)
{'key': 'ci0499469b00032/ci0499469b00032_1', 'first-page': '807', 'volume': '7', 'author': 'Kier L. B.', 'year': '1990', 'journal-title': 'Pharm. Res.'} / Pharm. Res. by Kier L. B. (1990)
{'key': 'ci0499469b00033/ci0499469b00033_1', 'volume-title': 'Molecular Structure Description. The Electrotopological State', 'author': 'Kier L. B.', 'year': '1999'} / Molecular Structure Description. The Electrotopological State by Kier L. B. (1999)
Vinogradov, S. N.; Linnell, R. H.Hydrogen Bonding; Van Nostrand Reinhold: New York, 1971.
10.1021/ac00220a013 / Anal. Chem. by Stanton D. T. (1990)
{'key': 'ci0499469b00036/ci0499469b00036_1', 'volume-title': 'Chemistry', 'author': 'Mattioni B. E.', 'year': '2003'} / Chemistry by Mattioni B. E. (2003)
10.1021/ci00023a011 / J. Chem. Inf. Comput Sci. by Sutter J. M. (1995)
{'key': 'ci0499469b00038/ci0499469b00038_1', 'volume-title': 'Genetic Algorithms in Search Optimization & Machine Learning', 'author': 'Goldberg D. E.', 'year': '2000'} / Genetic Algorithms in Search Optimization & Machine Learning by Goldberg D. E. (2000)
10.1021/ci00043a009 / J. Chem. Inf. Comput Sci. by Randic M (1984)
10.1021/ja00856a001 / J. Am. Chem. Soc. by Randic M (1972)
{'key': 'ci0499469b00041/ci0499469b00041_1', 'first-page': '394', 'volume': '38', 'author': 'Liu S.', 'year': '1998', 'journal-title': 'J. Chem. Inf. Comput Sci.'} / J. Chem. Inf. Comput Sci. by Liu S. (1998)
10.1002/0471725382 / Robust Regression and Outlier Detection by Rousseeuw P. J. (1987)
R Development Core Team 2003: R: A Language and Environment forStatistical Computing.http://www.R-project.org.
10.1021/ci0340658 / J. Chem. Inf. Comput Sci. by Stanton D. T (2003)
{'key': 'ci0499469b00045/ci0499469b00045_1', 'volume-title': 'v. 14', 'author': 'Minitab'} / v. 14 by Minitab
10.1002/qsar.19850040304 / Quant. Struct-Act. Relat. Pharmacol., Chem. Biol. by Kier L. B (1985)
10.1002/qsar.19860050103 / Quant. Struct-Act. Relat. Pharmacol., Chem. Biol. by Kier L. B (1986)
{'key': 'ci0499469b00048/ci0499469b00048_1', 'volume-title': 'Chem. Biol.', 'author': 'Kier L. B.', 'year': '1986'} / Chem. Biol. by Kier L. B. (1986)
10.1016/0009-2614(82)80009-2 / Chem. Phys. Lett. by Balaban A. T (1982)
{'key': 'ci0499469b00050/ci0499469b00050_1', 'volume-title': 'Methods and Principles in Medicinal Chemistry', 'author': 'Todeschini R.', 'year': '2000'} / Methods and Principles in Medicinal Chemistry by Todeschini R. (2000)
10.1109/69.824621 / IEE Trans. Know. Data. Eng. by Gupta A. (1999)
{'key': 'ci0499469b00052/ci0499469b00052_1', 'first-page': '119', 'volume': '17', 'author': 'Ney H', 'year': '1995', 'journal-title': 'IEEE Trans. Pat. Anal. Mach. Intell.'} / IEEE Trans. Pat. Anal. Mach. Intell. by Ney H (1995)
{'key': 'ci0499469b00053/ci0499469b00053_1', 'first-page': '1401', 'volume': '10', 'author': 'Schmitz G. P. J.', 'year': '1999', 'journal-title': 'IEEE Trans. Neural. Net.'} / IEEE Trans. Neural. Net. by Schmitz G. P. J. (1999)
10.1109/TNN.2002.1000125 / Extraction of Rules from Artificial Neural Networks for Nonlinear regression by Setiono R.

Dates

Type	When
Created	21 years, 1 month ago (July 26, 2004, 12:26 a.m.)
Deposited	2 years, 5 months ago (March 23, 2023, 6:31 p.m.)
Indexed	1 month, 3 weeks ago (July 11, 2025, 6:36 a.m.)
Issued	21 years, 4 months ago (April 21, 2004)
Published	21 years, 4 months ago (April 21, 2004)
Published Online	21 years, 4 months ago (April 21, 2004)
Published Print	21 years, 2 months ago (July 1, 2004)

Funders 0

None

BibTeX

@article{Guha_2004, title={Development of QSAR Models To Predict and Interpret the Biological Activity of Artemisinin Analogues}, volume={44}, ISSN={1520-5142}, url={http://dx.doi.org/10.1021/ci0499469}, DOI={10.1021/ci0499469}, number={4}, journal={Journal of Chemical Information and Computer Sciences}, publisher={American Chemical Society (ACS)}, author={Guha, Rajarshi and Jurs, Peter C.}, year={2004}, month=apr, pages={1440–1449} }

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      "author": "Robert A.",
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      "first-page": "132",
      "volume": "121",
      "author": "Avery M. A.",
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      "first-page": "181",
      "DOI": "10.1023/A:1007967517859",
      "volume": "12",
      "author": "Woolfrey J. R.",
      "year": "1998",
      "journal-title": "J. Comput.-Aided Mol. Des."
    },
    {
      "key": "ci0499469b00009/ci0499469b00009_1",
      "first-page": "217",
      "volume": "4",
      "author": "Avery M. A.",
      "year": "1999",
      "journal-title": "Adv. Med. Chem."
    },
    {
      "key": "ci0499469b00010/ci0499469b00010_1",
      "first-page": "303",
      "volume": "45",
      "author": "Avery M. A.",
      "year": "2002",
      "journal-title": "J. Med. Chem."
    },
    {
      "key": "ci0499469b00011/ci0499469b00011_1",
      "first-page": "409",
      "volume": "12",
      "author": "Tommuphean S.",
      "year": "1998",
      "journal-title": "J. Comput.-Aided Mol. Des."
    },
    {
      "key": "ci0499469b00012/ci0499469b00012_1",
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      "first-page": "4275",
      "DOI": "10.1021/jm00078a017",
      "volume": "36",
      "author": "Avery M. A.",
      "year": "1993",
      "journal-title": "J. Med. Chem."
    },
    {
      "key": "ci0499469b00013/ci0499469b00013_1",
      "first-page": "2891",
      "volume": "10",
      "author": "Cheng F.",
      "year": "2002",
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    },
    {
      "key": "ci0499469b00014/ci0499469b00014_1",
      "doi-asserted-by": "crossref",
      "first-page": "1407",
      "DOI": "10.1021/ci0004558",
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      "author": "Girones X.",
      "year": "2000",
      "journal-title": "J. Chem. Inf. Comput Sci."
    },
    {
      "key": "ci0499469b00015/ci0499469b00015_1",
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      "author": "Tonmunphean S.",
      "year": "2000",
      "journal-title": "Quant. Struct.-Act. Relat."
    },
    {
      "key": "ci0499469b00016/ci0499469b00016_1",
      "first-page": "5967",
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      "author": "Cramer III, R. D.",
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    },
    {
      "key": "ci0499469b00017/ci0499469b00017_1",
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      "author": "Cramer III, R. D.",
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      "key": "ci0499469b00018/ci0499469b00018_1",
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    },
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      "key": "ci0499469b00019/ci0499469b00019_1",
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    },
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      "key": "ci0499469b00020/ci0499469b00020_1",
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      "journal-title": "J. Med. Chem."
    },
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      "author": "Kauffman G. W.",
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      "key": "ci0499469b00033/ci0499469b00033_1",
      "volume-title": "Molecular Structure Description. The Electrotopological State",
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      "key": "ci0499469b00035/ci0499469b00035_1",
      "doi-asserted-by": "crossref",
      "first-page": "2329",
      "DOI": "10.1021/ac00220a013",
      "volume": "62",
      "author": "Stanton D. T.",
      "year": "1990",
      "journal-title": "Anal. Chem."
    },
    {
      "key": "ci0499469b00036/ci0499469b00036_1",
      "volume-title": "Chemistry",
      "author": "Mattioni B. E.",
      "year": "2003"
    },
    {
      "key": "ci0499469b00037/ci0499469b00037_1",
      "doi-asserted-by": "crossref",
      "first-page": "84",
      "DOI": "10.1021/ci00023a011",
      "volume": "35",
      "author": "Sutter J. M.",
      "year": "1995",
      "journal-title": "J. Chem. Inf. Comput Sci."
    },
    {
      "key": "ci0499469b00038/ci0499469b00038_1",
      "volume-title": "Genetic Algorithms in Search Optimization & Machine Learning",
      "author": "Goldberg D. E.",
      "year": "2000"
    },
    {
      "key": "ci0499469b00039/ci0499469b00039_1",
      "doi-asserted-by": "crossref",
      "first-page": "175",
      "DOI": "10.1021/ci00043a009",
      "volume": "24",
      "author": "Randic M",
      "year": "1984",
      "journal-title": "J. Chem. Inf. Comput Sci."
    },
    {
      "key": "ci0499469b00040/ci0499469b00040_1",
      "doi-asserted-by": "crossref",
      "first-page": "6609",
      "DOI": "10.1021/ja00856a001",
      "volume": "97",
      "author": "Randic M",
      "year": "1972",
      "journal-title": "J. Am. Chem. Soc."
    },
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      "key": "ci0499469b00041/ci0499469b00041_1",
      "first-page": "394",
      "volume": "38",
      "author": "Liu S.",
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      "key": "ci0499469b00043/ci0499469b00043_1",
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      "DOI": "10.1021/ci0340658",
      "volume": "43",
      "author": "Stanton D. T",
      "year": "2003",
      "journal-title": "J. Chem. Inf. Comput Sci."
    },
    {
      "key": "ci0499469b00045/ci0499469b00045_1",
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      "first-page": "116",
      "DOI": "10.1002/qsar.19850040304",
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      "author": "Kier L. B",
      "year": "1985",
      "journal-title": "Quant. Struct-Act. Relat. Pharmacol., Chem. Biol."
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      "key": "ci0499469b00048/ci0499469b00048_1",
      "volume-title": "Chem. Biol.",
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      "DOI": "10.1016/0009-2614(82)80009-2",
      "volume": "89",
      "author": "Balaban A. T",
      "year": "1982",
      "journal-title": "Chem. Phys. Lett."
    },
    {
      "key": "ci0499469b00050/ci0499469b00050_1",
      "volume-title": "Methods and Principles in Medicinal Chemistry",
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      "DOI": "10.1109/69.824621",
      "volume": "11",
      "author": "Gupta A.",
      "year": "1999",
      "journal-title": "IEE Trans. Know. Data. Eng."
    },
    {
      "key": "ci0499469b00052/ci0499469b00052_1",
      "first-page": "119",
      "volume": "17",
      "author": "Ney H",
      "year": "1995",
      "journal-title": "IEEE Trans. Pat. Anal. Mach. Intell."
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      "key": "ci0499469b00053/ci0499469b00053_1",
      "first-page": "1401",
      "volume": "10",
      "author": "Schmitz G. P. J.",
      "year": "1999",
      "journal-title": "IEEE Trans. Neural. Net."
    },
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      "key": "ci0499469b00054/ci0499469b00054_1",
      "doi-asserted-by": "crossref",
      "volume-title": "Extraction of Rules from Artificial Neural Networks for Nonlinear regression",
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