Willem P. van Hoorn

According to our database, Willem P. van Hoorn authored at least 6 papers between 2007 and 2023.

Collaborative distances:

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

2023

Testing the limits of SMILES-based de novo molecular generation with curriculum and deep reinforcement learning.

Maranga Mokaya, Fergus Imrie, Willem P. van Hoorn, Aleksandra Kalisz, Anthony R. Bradley, Charlotte M. Deane

Nat. Mac. Intell., April, 2023

2022

Coverage Score: A Model Agnostic Method to Efficiently Explore Chemical Space.

Daniel J. Woodward, Anthony R. Bradley, Willem P. van Hoorn

J. Chem. Inf. Model., 2022

2011

Design of a multi-purpose fragment screening library using molecular complexity and orthogonal diversity metrics.

Wan F. Lau, Jane M. Withka, David Hepworth, Thomas V. Magee, Yuhua J. Du, Gregory A. Bakken, Michael D. Miller, Zachary S. Hendsch, Venkataraman Thanabal, Steve A. Kolodziej, Li Xing, Qiyue Hu, Lakshmi S. Narasimhan, Robert Love, Maura E. Charlton, Samantha Hughes, Willem P. van Hoorn, James E. J. Mills

J. Comput. Aided Mol. Des., 2011

2010

Predicting cytotoxicity from heterogeneous data sources with Bayesian learning.

Sarah R. Langdon, Joanna Mulgrew, Gaia Valeria Paolini, Willem P. van Hoorn

J. Cheminformatics, 2010

2009

Searching Chemical Space with the Bayesian Idea Generator.

Willem P. van Hoorn, Andrew Bell

J. Chem. Inf. Model., 2009

2007

Designing Compound Subsets: Comparison of Random and Rational Approaches Using Statistical Simulation.

Siew K. Yeap, Rosalind J. Walley, Michael Snarey, Willem P. van Hoorn, Jonathan S. Mason

J. Chem. Inf. Model., 2007