Morgan C. Thomas

According to our database, Morgan C. Thomas authored at least 5 papers between 2021 and 2024.

Collaborative distances:

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

2024

MolScore: a scoring, evaluation and benchmarking framework for generative models in de novo drug design.

Morgan C. Thomas, Noel M. O'Boyle, Andreas Bender, Chris de Graaf

J. Cheminformatics, December, 2024

2023

On the difficulty of validating molecular generative models realistically: a case study on public and proprietary data.

Koichi Handa, Morgan C. Thomas, Michiharu Kageyama, Takeshi Iijima, Andreas Bender

J. Cheminformatics, December, 2023

2022

Augmented Hill-Climb increases reinforcement learning efficiency for language-based de novo molecule generation.

Morgan C. Thomas, Noel M. O'Boyle, Andreas Bender, Chris de Graaf

J. Cheminformatics, 2022

Re-evaluating sample efficiency in de novo molecule generation.

Morgan C. Thomas, Noel M. O'Boyle, Andreas Bender, Chris de Graaf

CoRR, 2022

2021

Comparison of structure- and ligand-based scoring functions for deep generative models: a GPCR case study.

Morgan C. Thomas, Robert T. Smith, Noel M. O'Boyle, Chris de Graaf, Andreas Bender

J. Cheminformatics, 2021