2008 |
4 | EE | Noel M. O'Boyle,
Adam L. Tenderholt,
Karol M. Langner:
cclib: A library for package-independent computational chemistry algorithms.
Journal of Computational Chemistry 29(5): 839-845 (2008) |
2007 |
3 | EE | Gemma L. Holliday,
Daniel E. Almonacid,
Gail J. Bartlett,
Noel M. O'Boyle,
James W. Torrance,
Peter Murray-Rust,
John B. O. Mitchell,
Janet M. Thornton:
MACiE (Mechanism, Annotation and Classification in Enzymes): novel tools for searching catalytic mechanisms.
Nucleic Acids Research 35(Database-Issue): 515-520 (2007) |
2006 |
2 | EE | Roger M. Jarvis,
David Broadhurst,
Helen E. Johnson,
Noel M. O'Boyle,
Royston Goodacre:
PYCHEM: a multivariate analysis package for python.
Bioinformatics 22(20): 2565-2566 (2006) |
2005 |
1 | EE | Gemma L. Holliday,
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.
Bioinformatics 21(23): 4315-4316 (2005) |