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Journal of Computer-Aided Molecular Design
|
August 29, 2002
Effectiveness of graph-based and fingerprint-based similarity measures for virtual screening of 2D chemical structure databases
John W Raymond, Peter Willett
Journal of Chemical Information and Computer Sciences
|
May 28, 2003
Similarity searching in databases of flexible 3D structures using smoothed bounded distance matrices
John W Raymond, Peter Willett
Journal of Computer-Aided Molecular Design
|
January 4, 2003
Maximum common subgraph isomorphism algorithms for the matching of chemical structures
John W Raymond, Peter Willett
Journal of Chemical Information and Modeling
|
September 27, 2005
An automated method for exploring targeted substructural diversity within sets of chemical structures
John W Raymond, Christopher E Kibbey
BMC Bioinformatics
|
October 28, 2018
DeepSort: deep convolutional networks for sorting haploid maize seeds
Balaji Veeramani, John W Raymond, Pritam Chanda
Journal of Computational Chemistry
|
July 28, 2010
The flexible alignment of molecular structures using simulated annealing with weighted Lagrangian multipliers
John W Raymond, Daniel D Holsworth, Mehran Jalaie
Journal of Chemical Information and Computer Sciences
|
March 23, 2004
Conditional probability: a new fusion method for merging disparate virtual screening results
John W Raymond, Mehran Jalaie, Mary P Bradley
Journal of Molecular Graphics & Modelling
|
January 25, 2003
Comparison of chemical clustering methods using graph- and fingerprint-based similarity measures
John W Raymond, C John Blankley, Peter Willett
Journal of Chemical Information and Computer Sciences
|
March 26, 2002
Heuristics for similarity searching of chemical graphs using a maximum common edge subgraph algorithm
John W Raymond, Eleanor J Gardiner, Peter Willett
Journal of Chemical Information and Modeling
|
July 17, 2009
Rationalizing lead optimization by associating quantitative relevance with molecular structure modification
John W Raymond, Ian A Watson, Abdelaziz Mahoui
Page
of 2
Search research articles
Search
Showing results (1-10 of 11) with videos related to
Sort By:
Page
of 2
Journal of Computer-Aided Molecular Design
|
August 29, 2002
Effectiveness of graph-based and fingerprint-based similarity measures for virtual screening of 2D chemical structure databases
John W Raymond, Peter Willett
Journal of Chemical Information and Computer Sciences
|
May 28, 2003
Similarity searching in databases of flexible 3D structures using smoothed bounded distance matrices
John W Raymond, Peter Willett
Journal of Computer-Aided Molecular Design
|
January 4, 2003
Maximum common subgraph isomorphism algorithms for the matching of chemical structures
John W Raymond, Peter Willett
Journal of Chemical Information and Modeling
|
September 27, 2005
An automated method for exploring targeted substructural diversity within sets of chemical structures
John W Raymond, Christopher E Kibbey
BMC Bioinformatics
|
October 28, 2018
DeepSort: deep convolutional networks for sorting haploid maize seeds
Balaji Veeramani, John W Raymond, Pritam Chanda
Journal of Computational Chemistry
|
July 28, 2010
The flexible alignment of molecular structures using simulated annealing with weighted Lagrangian multipliers
John W Raymond, Daniel D Holsworth, Mehran Jalaie
Journal of Chemical Information and Computer Sciences
|
March 23, 2004
Conditional probability: a new fusion method for merging disparate virtual screening results
John W Raymond, Mehran Jalaie, Mary P Bradley
Journal of Molecular Graphics & Modelling
|
January 25, 2003
Comparison of chemical clustering methods using graph- and fingerprint-based similarity measures
John W Raymond, C John Blankley, Peter Willett
Journal of Chemical Information and Computer Sciences
|
March 26, 2002
Heuristics for similarity searching of chemical graphs using a maximum common edge subgraph algorithm
John W Raymond, Eleanor J Gardiner, Peter Willett
Journal of Chemical Information and Modeling
|
July 17, 2009
Rationalizing lead optimization by associating quantitative relevance with molecular structure modification
John W Raymond, Ian A Watson, Abdelaziz Mahoui
Page
of 2