All papers authored by Noel O'Boyle
Refreshing results…
2012
Kevin S. Eccles,
Robin E. Morrison,
Stephen P. Stokes,
Graham E. O’Mahony,
John A. Hayes,
Dawn M. Kelly,
Noel M. O'Boyle 
,
László Fábián,
Humphrey A. Moynihan,
Anita R. Maguire,
Simon E. Lawrence
,
László Fábián,
Humphrey A. Moynihan,
Anita R. Maguire,
Simon E. Lawrence
Utilizing Sulfoxide···Iodine Halogen Bonding for Cocrystallization
Download from cora.ucc.ie
2011
Noel M. O'Boyle ,
Tim Vandermeersch,
Christopher J. Flynn,
Anita R. Maguire,
Geoffrey R. Hutchison
,
Tim Vandermeersch,
Christopher J. Flynn,
Anita R. Maguire,
Geoffrey R. Hutchison
Confab - Systematic generation of diverse low-energy conformers
Download from dx.doi.org
Noel M. O'Boyle ,
Michael Banck,
Craig A. James,
Chris Morley,
Tim Vandermeersch,
Geoffrey R. Hutchison
,
Michael Banck,
Craig A. James,
Chris Morley,
Tim Vandermeersch,
Geoffrey R. Hutchison
Open Babel: An open chemical toolbox
Download from link.springer.com
Noel M. O'Boyle ,
Rajarshi Guha,
Egon L. Willighagen,
Samuel E. Adams,
Jonathan Alvarsson,
Richard L. Apodaca,
Jean-Claude Bradley ,
Igor V. Filippov,
Robert M. Hanson,
Marcus D. Hanwell,
Geoffrey R. Hutchison ,
Craig A. James James,
Nina Jeliazkova,
Andrew Sid I. D. Lang,
Karol M. Langner
and 9 other authors
,
Rajarshi Guha,
Egon L. Willighagen,
Samuel E. Adams,
Jonathan Alvarsson,
Richard L. Apodaca,
Jean-Claude Bradley ,
Igor V. Filippov,
Robert M. Hanson,
Marcus D. Hanwell,
Geoffrey R. Hutchison ,
Craig A. James James,
Nina Jeliazkova,
Andrew Sid I. D. Lang,
Karol M. Langner
and 9 other authors
Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on
Download from dx.doi.org
2007
Noel M. O'Boyle ,
Adam L. Tenderholt,
Karol M. Langner
,
Adam L. Tenderholt,
Karol M. Langner
cclib: A library for package-independent computational chemistry algorithms
Download from www.researchgate.net
Noel M. O'Boyle ,
Gemma L. Holliday ,
Daniel E. Almonacid,
John B. O. Mitchell
,
Gemma L. Holliday ,
Daniel E. Almonacid,
John B. O. Mitchell
Using Reaction Mechanism to Measure Enzyme Similarity
Download from europepmc.org
R. Wesley,
William,
Wesley R. Browne,
Paolo,
Paolo Passaniti,
Maria Teresa,
Maria Teresa Gandolfi,
Roberto,
Roberto Ballardini,
William Henry,
Adrian,
Adrian Guckian,
Noel,
Noel O'Boyle ,
J. John
and 3 other authors
Download from www.researchgate.net
,
J. John
and 3 other authors
Download from www.researchgate.net
Noel M. O. Boyle,
Gemma L. Holliday ,
Daniel E. Almonacid,
Gail J. Bartlett,
Noel M. O'Boyle ,
James W. Torrance,
Peter Murray-Rust ,
John Blayney Owen Mitchell,
Janet M. Thornton
Download from doi.org
,
Daniel E. Almonacid,
Gail J. Bartlett,
Noel M. O'Boyle ,
James W. Torrance,
Peter Murray-Rust ,
John Blayney Owen Mitchell,
Janet M. Thornton
Download from doi.org
Egon L. Willighagen ,
Noel M. O'Boyle ,
Harini Gopalakrishnan,
Dazhi Jiao,
Rajarshi Guha,
Christoph Steinbeck,
David J. Wild
,
Noel M. O'Boyle ,
Harini Gopalakrishnan,
Dazhi Jiao,
Rajarshi Guha,
Christoph Steinbeck,
David J. Wild
Userscripts for the Life Sciences
Download from dx.doi.org
2006
David S. Palmer,
Noel M. O'Boyle ,
Robert C. Glen,
John B. O. Mitchell
,
Robert C. Glen,
John B. O. Mitchell
Random Forest Models To Predict Aqueous Solubility
Download from www.researchgate.net
Rm M. Jarvis,
David Broadhurst,
Helen Johnson,
Nm M. O'Boyle ,
Royston Goodacre
,
Royston Goodacre
PYCHEM: a multivariate analysis package for python
Download from academic.oup.com
2005
Gemma L. Holliday ,
Gail J. Bartlett,
Daniel E. Almonacid,
Noel M. O'Boyle ,
Peter Murray-Rust,
Janet M. Thornton,
John B. O. Mitchell
,
Gail J. Bartlett,
Daniel E. Almonacid,
Noel M. O'Boyle ,
Peter Murray-Rust,
Janet M. Thornton,
John B. O. Mitchell
MACiE: A Database of Enzyme Reaction Mechanisms
Download from academic.oup.com
Wesley R. Browne,
Noel M. O'Boyle ,
William Henry,
Adrian L. Guckian,
Sabine Horn,
Thomas Fett,
Christine M. O'Connor,
Marco Duati,
Luisa De Cola,
Colin G. Coates,
Kate L. Ronayne,
John J. McGarvey,
Johannes G. Vos
Download from www.rug.nl
,
William Henry,
Adrian L. Guckian,
Sabine Horn,
Thomas Fett,
Christine M. O'Connor,
Marco Duati,
Luisa De Cola,
Colin G. Coates,
Kate L. Ronayne,
John J. McGarvey,
Johannes G. Vos
Download from www.rug.nl
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