Samuel E. Adams

According to our database, Samuel E. Adams authored at least 12 papers between 2010 and 2013.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2013

How Do Metabolites Differ from Their Parent Molecules and How Are They Excreted?

Johannes Kirchmair, Andrew Howlett, Julio E. Peironcely, Daniel S. Murrell, Mark J. Williamson, Samuel E. Adams, Thomas Hankemeier, Leo van Buren, Guus Duchateau, Werner Klaffke, Robert C. Glen

J. Chem. Inf. Model., 2013

Applications of the InChI in cheminformatics with the CDK and Bioclipse.

Ola Spjuth, Arvid Berg, Samuel E. Adams, Egon L. Willighagen

J. Cheminformatics, 2013

Quantifying the shifts in physicochemical property space introduced by the metabolism of small organic molecules.

Johannes Kirchmair, Andrew Howlett, Julio E. Peironcely, Daniel S. Murrell, Mark J. Williamson, Samuel E. Adams, Thomas Hankemeier, Leo van Buren, Guus Duchateau, Werner Klaffke, Robert C. Glen

J. Cheminformatics, 2013

2012

Chempound - a Web 2.0-inspired repository for physical science data.

Sam E. Adams, Peter Murray-Rust

J. Digit. Inf., 2012

2011

Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on.

Noel M. O'Boyle, Rajarshi Guha, Egon L. Willighagen, Sam E. Adams, Jonathan Alvarsson, Jean-Claude Bradley, Igor V. Filippov, Robert M. Hanson, Marcus D. Hanwell, Geoffrey R. Hutchison, Craig A. James, Nina Jeliazkova, Andrew S. I. D. Lang, Karol M. Langner, David C. Lonie, Daniel M. Lowe, Jérôme Pansanel, Dmitry Pavlov, Ola Spjuth, Christoph Steinbeck, Adam L. Tenderholt, Kevin J. Theisen, Peter Murray-Rust

J. Cheminformatics, 2011

The semantics of Chemical Markup Language (CML): dictionaries and conventions.

Peter Murray-Rust, Joe Townsend, Sam E. Adams, Weerapong Phadungsukanan, Jens Thomas

J. Cheminformatics, 2011

The semantic architecture of the World-Wide Molecular Matrix (WWMM).

Peter Murray-Rust, Sam E. Adams, Jim Downing, Joe Townsend, Yong Zhang

J. Cheminformatics, 2011

OSCAR4: a flexible architecture for chemical text-mining.

David M. Jessop, Sam E. Adams, Egon L. Willighagen, Lezan Hawizy, Peter Murray-Rust

J. Cheminformatics, 2011

Mining chemical information from open patents.

David M. Jessop, Sam E. Adams, Peter Murray-Rust

J. Cheminformatics, 2011

Ami - The chemist's amanuensis.

Brian Brooks, Adam L. Thorn, Matthew Smith, Peter Matthews, Shaoming Chen, Ben O'Steen, Sam E. Adams, Joe Townsend, Peter Murray-Rust

J. Cheminformatics, 2011

The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age.

Sam E. Adams, Pablo de Castro, Pablo Echenique, Jorge Estrada, Marcus D. Hanwell, Peter Murray-Rust, Paul Sherwood, Jens Thomas, Joe Townsend

J. Cheminformatics, 2011

2010

Use of historic metabolic biotransformation data as a means of anticipating metabolic sites using MetaPrint2D and Bioclipse.

Lars Carlsson, Ola Spjuth, Samuel E. Adams, Robert C. Glen, Scott Boyer

BMC Bioinform., 2010