DOI: 10.1007/s10822-004-6986-2. The de novo design of median molecules within a property range of interest

The de novo design of median molecules within a property range of interest

10.1007/s10822-004-6986-2

Crossref journal-article

Springer Science and Business Media LLC

Journal of Computer-Aided Molecular Design (297)

Bibliography

Brown, N., McKay, B., & Gasteiger, J. (2004). The de novo design of median molecules within a property range of interest. Journal of Computer-Aided Molecular Design, 18(12), 761â771.

Authors 3

Nathan Brown (first)
Ben McKay (additional)
Johann Gasteiger (additional)

References 18 Referenced 31

10.1021/ci00046a002 / J. Chem Inf. Comput. Sci., by R.E. Carhart (1985)
10.1021/ci00049a008 / J. Chem Inf. Comput. Sci., by P. Willett (1986)
10.1021/ci9800211 / J. Chem Inf. Comput. Sci., by P. Willett (1998)
10.1021/ci034290p / J. Chem Inf. Comput. Sci., by N. Brown (2004)
{'key': '6986_CR5', 'first-page': '5', 'volume-title': 'The 15th European Symposium on Quantitative Structure–Activity Relationships', 'author': 'N. Brown', 'year': '(September 2004).'} / The 15th European Symposium on Quantitative Structure–Activity Relationships by N. Brown ((September 2004).)
{'key': '6986_CR6', 'first-page': '416', 'volume-title': 'Genetic Algorithms: Proceedings of the Fifth International Conference', 'author': 'C.M. Fonseca', 'year': '1993'} / Genetic Algorithms: Proceedings of the Fifth International Conference by C.M. Fonseca (1993)
10.1021/ci970438r / J. Chem Inf. Comput. Sci., by S. Handschuh (1998)
10.1023/A:1010072431120 / Genet Program. Evolvable Mach., by R.B. Nachbar (2000)
{'key': '6986_CR9', 'volume-title': 'Concepts and Applications of Molecular Similarity', 'author': 'M.A. Johnson', 'year': '1990'} / Concepts and Applications of Molecular Similarity by M.A. Johnson (1990)
The SIMCA-P 10.5 software is available from Umetrics at http://www.umetrics.com/.
10.1021/ja00179a044 / J. Chem. Chem. Soc., by K.J. Miller (1990)
The PETRA software is available from Molecular Networks, GmbH at http://www.mol-net.com.
The Dragon 4 software is available from Talete, Srl at http://www.talete.mi.it/.
10.1021/ci970100x / J. Chem Inf. Comput. Sci., by J. Huuskonen (1998)
10.1002/qsar.200330822 / QSAR Comb Sci., by A. Yan (2003)
10.1023/A:1027221424359 / Perspect Drug. Discov. Des. by H. Kubinyi (1998)
10.1021/jm020155c / J. Med Chem. by Y.C. Martin (2002)
10.2174/1386207013331129 / Comb Chem. High Throughput Screen. by J.V. Julián-Ortiz de (2001)

Dates

Type	When
Created	20 years, 2 months ago (June 27, 2005, 8:06 p.m.)
Deposited	6 years, 3 months ago (May 30, 2019, 5:22 p.m.)
Indexed	1 day, 6 hours ago (Aug. 31, 2025, 6:27 a.m.)
Issued	20 years, 9 months ago (Dec. 1, 2004)
Published	20 years, 9 months ago (Dec. 1, 2004)
Published Online	20 years, 2 months ago (June 27, 2005)
Published Print	20 years, 9 months ago (Dec. 1, 2004)

Funders 0

None

BibTeX

@article{Brown_2004, title={The de novo design of median molecules within a property range of interest}, volume={18}, ISSN={1573-4951}, url={http://dx.doi.org/10.1007/s10822-004-6986-2}, DOI={10.1007/s10822-004-6986-2}, number={12}, journal={Journal of Computer-Aided Molecular Design}, publisher={Springer Science and Business Media LLC}, author={Brown, Nathan and McKay, Ben and Gasteiger, Johann}, year={2004}, month=dec, pages={761–771} }

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