Scott Boyer

Publication Activity (10 Years)

Years Active: 2002-2015
Publications (10 Years): 1

Top Topics

Conformal Prediction

Predictive Modeling

Feature Selection

Top Venues

J. Chem. Inf. Model.

Ann. Math. Artif. Intell.

PLoS Comput. Biol.

Publications

Martin Eklund, Ulf Norinder, Scott Boyer, Lars Carlsson
The application of conformal prediction to the drug discovery process. Ann. Math. Artif. Intell. 74 (1-2) (2015)
Martin Eklund, Ulf Norinder, Scott Boyer, Lars Carlsson
Choosing Feature Selection and Learning Algorithms in QSAR. J. Chem. Inf. Model. 54 (3) (2014)
Marko Toplak, Rok Mocnik, Matija Polajnar, Zoran Bosnic, Lars Carlsson, Catrin Hasselgren Arnby, Janez Demsar, Scott Boyer, Blaz Zupan, Jonna C. Stålring
Assessment of Machine Learning Reliability Methods for Quantifying the Applicability Domain of QSAR Regression Models. J. Chem. Inf. Model. 54 (2) (2014)
Ernst Ahlberg Helgee, Lars Carlsson, Scott Boyer
Computational Derivation of Structural Alerts from Large Toxicology Data Sets. J. Chem. Inf. Model. 54 (10) (2014)
Ulf Norinder, Lars Carlsson, Scott Boyer, Martin Eklund
Introducing Conformal Prediction in Predictive Modeling. A Transparent and Flexible Alternative to Applicability Domain Determination. J. Chem. Inf. Model. 54 (6) (2014)
Jonna C. Stålring, Pedro Almeida, Lars Carlsson, Ernst Ahlberg Helgee, Catrin Hasselgren Arnby, Scott Boyer
Localized Heuristic Inverse Quantitative Structure Activity Relationship with Bulk Descriptors Using Numerical Gradients. J. Chem. Inf. Model. 53 (8) (2013)
Anna Bauer-Mehren, Erik M. van Mulligen, Paul Avillach, María del Carmen Carrascosa, Ricard García-Serna, Janet Piñero González, Bharat Singh, Pedro Lopes, José Luís Oliveira, Gayo Diallo, Ernst Ahlberg Helgee, Scott Boyer, Jordi Mestres, Ferran Sanz, Jan A. Kors, Laura Inés Furlong
Automatic Filtering and Substantiation of Drug Safety Signals. PLoS Comput. Biol. 8 (4) (2012)
Martin Eklund, Ulf Norinder, Scott Boyer, Lars Carlsson
Application of Conformal Prediction in QSAR. AIAI (2) (2012)
Jonna C. Stålring, Lars Carlsson, Pedro Almeida, Scott Boyer
AZOrange - High performance open source machine learning for QSAR modeling in a graphical programming environment. J. Cheminformatics 3 (2011)
Ola Spjuth, Martin Eklund, Ernst Ahlberg Helgee, Scott Boyer, Lars Carlsson
Integrated Decision Support for Assessing Chemical Liabilities. J. Chem. Inf. Model. 51 (8) (2011)
Ernst Ahlberg Helgee, Lars Carlsson, Scott Boyer, Ulf Norinder
Evaluation of Quantitative Structure-Activity Relationship Modeling Strategies: Local and Global Models. J. Chem. Inf. Model. 50 (4) (2010)
Lars Carlsson, Ola Spjuth, Samuel E. Adams, Robert C. Glen, Scott Boyer
Use of historic metabolic biotransformation data as a means of anticipating metabolic sites using MetaPrint2D and Bioclipse. BMC Bioinform. 11 (2010)
Lars Carlsson, Ernst Ahlberg Helgee, Scott Boyer
Interpretation of Nonlinear QSAR Models Applied to Ames Mutagenicity Data. J. Chem. Inf. Model. 49 (11) (2009)
Ernst Ahlberg Helgee, Lars Carlsson, Scott Boyer
A Method for Automated Molecular Optimization Applied to Ames Mutagenicity Data. J. Chem. Inf. Model. 49 (11) (2009)
Claire L. Gavaghan, Catrin Hasselgren Arnby, Niklas Blomberg, Gert Strandlund, Scott Boyer
Development, interpretation and temporal evaluation of a global QSAR of hERG electrophysiology screening data. J. Comput. Aided Mol. Des. 21 (4) (2007)
Scott Boyer, Catrin Hasselgren Arnby, Lars Carlsson, James Smith, Viktor Stein, Robert C. Glen
Reaction Site Mapping of Xenobiotic Biotransformations. J. Chem. Inf. Model. 47 (2) (2007)
Matthew Paul Gleeson, Andrew M. Davis, Kamaldeep K. Chohan, Stuart Paine, Scott Boyer, Claire L. Gavaghan, Catrin Hasselgren Arnby, Cecilia Kankkonen, Nan Albertson
Generation of in-silico cytochrome P450 1A2, 2C9, 2C19, 2D6, and 3A4 inhibition QSAR models. J. Comput. Aided Mol. Des. 21 (10-11) (2007)
Jordi Mestres, Lidia Martín-Couce, Elisabet Gregori-Puigjané, Montserrat Cases, Scott Boyer
Ligand-Based Approach to In Silico Pharmacology: Nuclear Receptor Profiling. J. Chem. Inf. Model. 46 (6) (2006)
Hans-Peter Eich, Guillermo de la Calle, Carlos Díaz, Scott Boyer, A. S. Peña, Bruno G. Loos, Peter Ghazal, Inge Bernstein
Practical Approaches to the Development of Biomedical Informatics: the INFOBIOMED Network of Excellence. MIE (2005)
Scott Boyer, Ismael Zamora
New methods in predictive metabolism. J. Comput. Aided Mol. Des. 16 (5-6) (2002)