Browsing by Author O'Boyle, Noel M

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PreviewIssue DateTitleAuthor(s)
Blue_Obelisk_Poster.pdf5-Jul-2011The Blue Obelisk CommunityO'Boyle, Noel M; Murray-Rust, Peter
3-Dec-2008Cinfony - combining Open Source cheminformatics toolkits behind a common interfaceO'Boyle, Noel M; Hutchison, Geoffrey R
4315.pdf27-Sep-2005MACiE: a database of enzyme reaction mechanismsHolliday, Gemma L; Bartlett, Gail J; Almonacid, Daniel E; O'Boyle, Noel M; Murray-Rust, Peter; Thornton, Janet M; Mitchell, John B O
4-Jun-2011Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years onO'Boyle, Noel M; Guha, Rajarshi; Willighagen, Egon L; Adams, Samuel E; Alvarsson, Jonathan; Apodaca, Richard L; Bradley, Jean-Claude; Filippov, Igor V; Hanson, Robert M; Hanwell, Marcus D; Hutchison, Geoffrey R; James, Craig A; Jeliazkova, Nina; Lang, Andrew S I D; Langner, Karol M; Lonie, David C; Lowe, Daniel M; Pansanel, Jerome; Pavlov, Dmitry; Spjuth, Ola; Steinbeck, Christoph; Tenderholt, Adam L; Theisen, Kevin J; Murray-Rust, Peter
1758-2946-3-37.pdf14-Oct-2011Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years onO'Boyle, Noel M; Guha, Rajarshi; Willighagen, Egon L; Adams, Samuel E; Alvarsson, Jonathan; Bradley, Jean-Claude; Filippov, Igor V; Hanson, Robert M; Hanwell, Marcus D; Hutchison, Geoffrey R; James, Craig A; Jeliazkova, Nina; Lang, Andrew SID; Langner, Karol M; Lonie, David C; Lowe, Daniel M; Pansanel, Jerome; Pavlov, Dmitry; Spjuth, Ola; Steinbeck, Christoph; Tenderholt, Adam L; Theisen, Kevin J; Murray-Rust, Peter
9-Mar-2008Pybel: a Python wrapper for the OpenBabel cheminformatics toolkitO'Boyle, Noel M; Morley, Chris; Hutchison, Geoffrey R
29-Oct-2008Simultaneous feature selection and parameter optimisation using an artificial ant colony: case study of melting point predictionO'Boyle, Noel M; Palmer, David S; Nigsch, Florian; Mitchell, John B O

Showing results 1 to 7 of 7