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ORCIDWesley Schaal
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2020 – today
- 2022
[j10]Akshai P. Sreenivasan
, Philip J. Harrison, Wesley Schaal, Damian J. Matuszewski, Kim Kultima, Ola Spjuth:
Predicting protein network topology clusters from chemical structure using deep learning. J. Cheminformatics 14(1): 47 (2022)- 2021
- [i1]Ola Spjuth, Marco Capuccini, Matteo Carone, Anders Larsson, Wesley Schaal, Jon Ander Novella, Oliver Stein, Morgan Ekmefjord, Paolo Di Tommaso, Evan W. Floden, Cédric Notredame, Pablo A. Moreno, Andreas Hellander, Payam Emami Khoonsari, Stephanie Herman, Kim Kultima, Samuel Lampa:
Approaches for containerized scientific workflows in cloud environments with applications in life science. F1000Research 10: 513 (2021) - 2020
- [j9]Laeeq Ahmed, Hiba Alogheli, Staffan Arvidsson McShane, Jonathan Alvarsson, Arvid Berg, Anders Larsson, Wesley Schaal, Erwin Laure, Ola Spjuth:
Predicting target profiles with confidence as a service using docking scores. J. Cheminformatics 12(1): 62 (2020)
2010 – 2019
- 2018
- [j8]Laeeq Ahmed, Valentin Georgiev, Marco Capuccini, Salman Zubair Toor, Wesley Schaal, Erwin Laure, Ola Spjuth:
Efficient iterative virtual screening with Apache Spark and conformal prediction. J. Cheminformatics 10(1): 8:1-8:8 (2018) - [j7]Maris Lapins, Staffan Arvidsson, Samuel Lampa, Arvid Berg, Wesley Schaal, Jonathan Alvarsson, Ola Spjuth:
A confidence predictor for logD using conformal regression and a support-vector machine. J. Cheminformatics 10(1): 17:1-17:10 (2018) - 2017
- [j6]Marco Capuccini, Laeeq Ahmed, Wesley Schaal, Erwin Laure, Ola Spjuth:
Large-scale virtual screening on public cloud resources with Apache Spark. J. Cheminformatics 9(1): 15:1-15:6 (2017) - [j5]Hiba Alogheli, Gustav Olanders, Wesley Schaal, Peter Brandt, Anders Karlén:
Docking of Macrocycles: Comparing Rigid and Flexible Docking in Glide. J. Chem. Inf. Model. 57(2): 190-202 (2017) - 2016
- [j4]Jonathan Alvarsson, Samuel Lampa, Wesley Schaal, Claes R. Andersson, Jarl E. S. Wikberg, Ola Spjuth:
Large-scale ligand-based predictive modelling using support vector machines. J. Cheminformatics 8(1): 39:1-39:9 (2016) - 2015
- [j3]Martin Lindh, Fredrik Svensson, Wesley Schaal, Jin Zhang, Christian Sköld, Peter Brandt, Anders Karlén:
Toward a Benchmarking Data Set Able to Evaluate Ligand- and Structure-based Virtual Screening Using Public HTS Data. J. Chem. Inf. Model. 55(2): 343-353 (2015) - 2013
- [j2]Wesley Schaal, Ulf Hammerling, Mats G. Gustafsson, Ola Spjuth:
Automated QuantMap for rapid quantitative molecular network topology analysis. Bioinform. 29(18): 2369-2370 (2013)
2000 – 2009
- 2006
- [j1]Shane D. Peterson, Wesley Schaal, Anders Karlén:
Improved CoMFA Modeling by Optimization of Settings. J. Chem. Inf. Model. 46(1): 355-364 (2006)
Coauthor Index
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