DOI: 10.1016/s1367-5931(99)80057-x. Chemoinformatics

Chemoinformatics — a new name for an old problem?

10.1016/s1367-5931(99)80057-x

Crossref journal-article

Elsevier BV

Current Opinion in Chemical Biology (78)

Bibliography

Hann, M., & Green, R. (1999). Chemoinformatics â a new name for an old problem? Current Opinion in Chemical Biology, 3(4), 379â383.

Authors 2

Mike Hann (first)
Richard Green (additional)

References 35 Referenced 66

10.1016/S0065-7743(08)61100-8 / Annu Rep Med Chem / Chemoinformatics: what is it and how does it impact drug discovery by Brown (1998)
10.1007/BF03380186 / Perspect Drug Discov Des / Challenges and prospects for computational aids to molecular diversity by Martin (1997)
10.1021/ci980485z / J Chem Inform Comput Sci / Golden anniversary of the ACS division of chemical information by American Chemical Society (1998)
{'key': '10.1016/S1367-5931(99)80057-X_bib4', 'first-page': '1', 'article-title': 'ACS symposium on chemical diversity', 'volume': '39', 'author': 'American Chemical Society', 'year': '1999'} / ACS symposium on chemical diversity by American Chemical Society (1999)
10.1023/A:1027221424359 / Perspect Drug Discov Des / Similarity and dissimilarity. A medicinal chemists view by Kubinyi (1998)
{'key': '10.1016/S1367-5931(99)80057-X_bib6', 'first-page': 'v', 'article-title': '3D QSAR in drug design. Theory, methods and applications', 'volume': '9–11', 'author': 'Kubinyi', 'year': '1998', 'journal-title': 'Perspect Drug Discov Des'} / Perspect Drug Discov Des / 3D QSAR in drug design. Theory, methods and applications by Kubinyi (1998)
{'key': '10.1016/S1367-5931(99)80057-X_bib7', 'first-page': 'v', 'article-title': '3D QSAR in drug design. Theory, methods and applications', 'volume': '12–14', 'author': 'Kubinyi', 'year': '1998', 'journal-title': 'Perspect Drug Discov Des'} / Perspect Drug Discov Des / 3D QSAR in drug design. Theory, methods and applications by Kubinyi (1998)
{'key': '10.1016/S1367-5931(99)80057-X_bib8', 'author': 'Leach', 'year': '1996'} by Leach (1996)
10.1021/ci9800211 / J Chem Inform Comput Sci / Chemical similarity searching by Willett (1998)
{'key': '10.1016/S1367-5931(99)80057-X_bib10', 'series-title': 'Combinatorial Chemistry and Molecular Diversity in Drug Discovery', 'first-page': '369', 'article-title': 'Quantifying diversity', 'author': 'Martin', 'year': '1998'} / Combinatorial Chemistry and Molecular Diversity in Drug Discovery / Quantifying diversity by Martin (1998)
10.1023/A:1008068904628 / J Comput Aided Mol Des / Feature trees: a new molecular similarity measure based on tree matching by Rarey (1998)
10.1023/A:1027280526177 / Perspect Drug Discov Des / Explicit calculation of 3D molecular similarity by Good (1998)
10.1021/ci980109e / J Chem Inform Comput Sci / Molecular diversity and representativity in chemical databases by Bayada (1999)
10.1021/ci9801062 / J Chem Inform Comput Sci / Chemistry space metrics in diversity analysis, library design, and compound selection by Menard (1998)
10.1021/ci980332b / J Chem Inform Comput Sci / Selecting combinatorial libraries to optimize diversity and physical properties by Gillet (1999)
10.1021/jm970033y / J Med Chem / Designing combinatorial library mixtures using a genetic algorithm by Brown (1997)
10.1021/ci9800209 / J Chem Inform Comput Sci / Virtual compound libraries: a new approach to decision making in molecular discovery research by Cramer (1998)
10.1016/S0169-7439(99)00010-6 / Chemomet Intell Lab Sys / Approaches to the design of combinatorial libraries by Drewry (1999)
10.1021/ci970429i / J Chem Inf Comput Sci / RECAP-retrosynthetic combinatorial analysis procedure: a powerful new technique for identifying privileged molecular fragments with useful applications in combinatorial chemistry by Lewell (1998)
10.1021/ci970420g / J Chem Inform Comput Sci / The effectiveness of reactant pools for generating structurally-diverse combinatorial libraries by Gillet (1997)
Daylight Chemical Information Systems Inc. on the World Wide Web, URL http://www.daylight.com/
Afferent Systems Inc. on the World Wide Web, URL http://www.afferent.com/
Molecular Design Limited, Information Systems Inc. on the World Wide Web, URL http://www.MDLi.com/tech/centrallib.html/
Tripos, Inc. on the World Wide Web, URL http://www.tripos.com/
Synopsys Scientific Systems on the World Wide Web, URL http://www.synopsys.co.uk/
10.1021/ci980089g / J Chem Inform Comput Sci / Recursive partitioning analysis of a large structure-activity data set using three-dimensional descriptors by Chen (1998)
Molecular Simulations Inc. on the World Wide Web, URL http://www.msi.com
10.1021/ci9803233 / J Chem Inform Comput Sci / The application of chemical multipurpose internet mail extensions (Chemical MIME) . Internet standards to electronic mail and World Wide Web information exchange by Rzepa (1998)
Cherwell Scientific Publishing Ltd. on the World Wide Web, URL http://www.cherwell.com/
Chemical Computing Group Inc. on the World Wide Web, URL http://www.chemcomp.com/
Spotfire Inc. on the World Wide Web, URL http://www.spotfire.com/
Partek Inc. on the World Wide Web, URL http://www.partek.com/
Oxford Molecular Group on the World Wide Web, URL http://www.oxmol.co.uk/
10.1021/ci9800920 / J Chem Inform Comput Sci / Computational chemistry on commodity-type computers by Nicklaus (1998)
10.1016/S0169-409X(96)00423-1 / Adv Drug Deliv Rev / Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings by Lipinski (1997)

Dates

Type	When
Created	23 years, 1 month ago (July 25, 2002, 1:27 p.m.)
Deposited	6 years, 4 months ago (April 24, 2019, 6:26 p.m.)
Indexed	1 week, 1 day ago (Aug. 29, 2025, 5:45 a.m.)
Issued	26 years, 1 month ago (Aug. 1, 1999)
Published	26 years, 1 month ago (Aug. 1, 1999)
Published Print	26 years, 1 month ago (Aug. 1, 1999)

Funders 0

None

BibTeX

@article{Hann_1999, title={Chemoinformatics — a new name for an old problem?}, volume={3}, ISSN={1367-5931}, url={http://dx.doi.org/10.1016/s1367-5931(99)80057-x}, DOI={10.1016/s1367-5931(99)80057-x}, number={4}, journal={Current Opinion in Chemical Biology}, publisher={Elsevier BV}, author={Hann, Mike and Green, Richard}, year={1999}, month=aug, pages={379–383} }

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