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1

Pharmacophoric pattern matching in files of three-dimensional chemical structures: Characterization and use of generalized valence angle screens

Andrew R. Poirrette, Peter Willett, Frank H. Allen

Journal:

Journal of Molecular Graphics

Year:

1991

Language:

english

File:

PDF, 1.78 MB

english, 1991

2

Pharmacophoric pattern matching in files of three-dimensional chemical structures: Characterization and use of generalized torsion angle screens

Andrew R. Poirrette, Peter Willett, Frank H. Allen

Journal:

Journal of Molecular Graphics

Year:

1993

Language:

english

File:

PDF, 1.29 MB

english, 1993

3

Selection of screens for three-dimensional substructure searching

Janey K. Cringean, Catherine A. Pepperrell, Andrew R. Poirrette, Peter Willett

Journal:

Tetrahedron Computer Methodology

Year:

1990

Language:

english

File:

PDF, 707 KB

english, 1990

4

Structural similarity between binding sites in influenza sialidase and isocitrate dehydrogenase: Implications for an alternative approach to rational drug design

Andrew R. Poirrette, Helen M. Grindley, David W. Rice, Peter J. Artymiuk, Peter Willett

Journal:

Protein Science

Year:

1994

Language:

english

File:

PDF, 2.05 MB

english, 1994

5

Development of an atom mapping procedure for similarity searching in databases of three-dimensional chemical structures

Catherine A. Pepperrell, Andrew R. Poirrette, Peter Willett, Robin Taylor

Journal:

Pest Management Science

Year:

1991

Language:

english

File:

PDF, 754 KB

english, 1991

6

10.1038/40310

Artymiuk, Peter J., Poirrette, Andrew R., Rice, David W., Willett, Peter

Journal:

Year:

1997

Language:

english

File:

PDF, 480 KB

english, 1997

7

β—Glucosyltransferase and phosphorylase reveal their common theme

Artymiuk, Peter J., Rice, David W., Poirrette, Andrew R., Willett, Peter

Journal:

Natural Structural Biology

Year:

1995

File:

PDF, 1.50 MB

1995

8

Biotin carboxylase comes into the fold

Artymiuk, Peter J., Poirrette, Andrew R., Rice, David W., Willett, Peter

Journal:

Natural Structural Biology

Year:

1996

File:

PDF, 622 KB

1996

9

A tale of two synthetases

Artymiuk, Peter J., Rice, David W., Poirrette, Andrew R., Willet, Peter

Journal:

Natural Structural Biology

Year:

1994

File:

PDF, 487 KB

1994

10

Comparison of protein surfaces using a genetic algorithm

Andrew R. Poirrette, Peter J. Artymiuk, David W. Rice, Peter Willett

Journal:

Journal of Computer-Aided Molecular Design

Year:

1997

Language:

english

File:

PDF, 1.41 MB

english, 1997

11

A Graph-theoretic Approach to the Identification of Three-dimensional Patterns of Amino Acid Side-chains in Protein Structures

Peter J. Artymiuk, Andrew R. Poirrette, Helen M. Grindley, David W. Rice, Peter Willett

Journal:

Journal of Molecular Biology

Year:

1994

File:

PDF, 1.37 MB

1994

12

Better compounds faster: the development and exploitation of a desktop predictive chemistry toolkit

John G. Cumming, Jon Winter, Andrew Poirrette

Journal:

Drug Discovery Today

Year:

2012

Language:

english

File:

PDF, 414 KB

english, 2012

13

The Extent of the Relationship between the Graph-Theoretical and the Geometrical Shape Coefficients of Chemical Compounds

Bath, Peter A., Poirrette, Andrew R., Willett, Peter, Allen, Frank H.

Journal:

Journal of Chemical Information and Modeling

Year:

1995

Language:

english

File:

PDF, 380 KB

english, 1995

14

A System for Encoding and Searching Markush Structures

Cosgrove, David A., Green, Keith M., Leach, Andrew G., Poirrette, Andrew, Winter, Jon

Journal:

Journal of Chemical Information and Modeling

Year:

2012

Language:

english

File:

PDF, 1.49 MB

english, 2012

15

Identification of .beta.-sheet motifs, of .psi.-loops, and of patterns of amino acid residues in three-dimensional protein structures using a subgraph-isomorphism algorithm

Artymiuk, Peter J., Grindley, Helen M., Poirrette, Andrew R., Rice, David W., Ujah, Elizabeth C., Willett, Peter

Journal:

Journal of Chemical Information and Modeling

Year:

1994

Language:

english

File:

PDF, 1.08 MB

english, 1994

16

Similarity searching in databases of three-dimensional molecules and macromolecules

Artymiuk, Peter J., Bath, Peter A., Grindley, Helen M., Pepperrell, Catherine A., Poirrette, Andrew R., Rice, David W., Thorner, David A., Wild, David J., Willett, Peter, et al.,

Journal:

Journal of Chemical Information and Modeling

Year:

1992

Language:

english

File:

PDF, 2.55 MB

english, 1992

17

Similarity searching in files of three-dimensional chemical structures: Comparison of fragment-based measures of shape similarity

Bath, Peter A., Poirrette, Andrew R., Willett, Peter, Allen, Frank H.

Journal:

Journal of Chemical Information and Modeling

Year:

1994

Language:

english

File:

PDF, 951 KB

english, 1994

18

Response to Comment on "The Extent of the Relationship between the Graph-Theoretical and the Geometrical Shape Coefficients of Chemical Compounds"

Bath, Peter A., Poirrette, Andrew R., Willett, Peter, Allen, Frank H.

Journal:

Journal of Chemical Information and Modeling

Year:

1995

Language:

english

File:

PDF, 121 KB

english, 1995

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