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Noel M O'Boyle

Showing results (1-10 of 41) with videos related to

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Journal of Cheminformatics|September 20, 2012
Towards a Universal SMILES representation - A standard method to generate canonical SMILES based on the InChINoel M O'Boyle
Chemistry Central Journal|December 6, 2008
Cinfony--combining Open Source cheminformatics toolkits behind a common interfaceNoel M O'Boyle, Geoffrey R Hutchison
Journal of Cheminformatics|July 7, 2016
Comparing structural fingerprints using a literature-based similarity benchmarkNoel M O'Boyle, Roger A Sayle
Journal of Cheminformatics|April 26, 2014
What compound should I make next? Using Matched Molecular Series for prospective medicinal chemistryNoel M O'Boyle, Roger Sayle, Jonas Boström
Current Opinion in Structural Biology|September 3, 2023
Editorial overview: Artificial intelligence (AI) methodology in structural biologyAndreas Bender, Chris de Graaf, Noel M O'Boyle
Chemistry Central Journal|March 11, 2008
Pybel: a Python wrapper for the OpenBabel cheminformatics toolkitNoel M O'Boyle, Chris Morley, Geoffrey R Hutchison
Journal of Chemical Information and Modeling|June 7, 2008
Using buriedness to improve discrimination between actives and inactives in dockingNoel M O'Boyle, Suzanne C Brewerton, Robin Taylor
Database : the Journal of Biological Databases and Curation|April 10, 2016
Efficient chemical-disease identification and relationship extraction using Wikipedia to improve recallDaniel M Lowe, Noel M O'Boyle, Roger A Sayle
Journal of Computational Chemistry|September 13, 2007
cclib: a library for package-independent computational chemistry algorithmsNoel M O'Boyle, Adam L Tenderholt, Karol M Langner
Journal of Chemical Information and Modeling|August 4, 2009
Testing assumptions and hypotheses for rescoring success in protein-ligand dockingNoel M O'Boyle, John W Liebeschuetz, Jason C Cole
Pageof 5

Showing results (1-10 of 41) with videos related to

Sort By:
Pageof 5
Journal of Cheminformatics|September 20, 2012
Towards a Universal SMILES representation - A standard method to generate canonical SMILES based on the InChINoel M O'Boyle
Chemistry Central Journal|December 6, 2008
Cinfony--combining Open Source cheminformatics toolkits behind a common interfaceNoel M O'Boyle, Geoffrey R Hutchison
Journal of Cheminformatics|July 7, 2016
Comparing structural fingerprints using a literature-based similarity benchmarkNoel M O'Boyle, Roger A Sayle
Journal of Cheminformatics|April 26, 2014
What compound should I make next? Using Matched Molecular Series for prospective medicinal chemistryNoel M O'Boyle, Roger Sayle, Jonas Boström
Current Opinion in Structural Biology|September 3, 2023
Editorial overview: Artificial intelligence (AI) methodology in structural biologyAndreas Bender, Chris de Graaf, Noel M O'Boyle
Chemistry Central Journal|March 11, 2008
Pybel: a Python wrapper for the OpenBabel cheminformatics toolkitNoel M O'Boyle, Chris Morley, Geoffrey R Hutchison
Journal of Chemical Information and Modeling|June 7, 2008
Using buriedness to improve discrimination between actives and inactives in dockingNoel M O'Boyle, Suzanne C Brewerton, Robin Taylor
Database : the Journal of Biological Databases and Curation|April 10, 2016
Efficient chemical-disease identification and relationship extraction using Wikipedia to improve recallDaniel M Lowe, Noel M O'Boyle, Roger A Sayle
Journal of Computational Chemistry|September 13, 2007
cclib: a library for package-independent computational chemistry algorithmsNoel M O'Boyle, Adam L Tenderholt, Karol M Langner
Journal of Chemical Information and Modeling|August 4, 2009
Testing assumptions and hypotheses for rescoring success in protein-ligand dockingNoel M O'Boyle, John W Liebeschuetz, Jason C Cole
Pageof 5