Protein–ligand scoring with convolutional neural networks M Ragoza, J Hochuli, E Idrobo, J Sunseri, DR Koes Journal of chemical information and modeling 57 (4), 942-957, 2017 | 679 | 2017 |
Protein-ligand scoring with convolutional neural networks D Koes, M Ragoza, E Idrobo, J Hochuli, J Sunseri ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 253, 2017 | 679* | 2017 |
Visualizing convolutional neural network protein-ligand scoring J Hochuli, A Helbling, T Skaist, M Ragoza, DR Koes Journal of Molecular Graphics and Modelling 84, 96-108, 2018 | 92 | 2018 |
Accurate inference of tree topologies from multiple sequence alignments using deep learning A Suvorov, J Hochuli, DR Schrider Systematic biology 69 (2), 221-233, 2020 | 51 | 2020 |
SCAM Detective: Accurate Predictor of Small, Colloidally Aggregating Molecules VM Alves, SJ Capuzzi, RC Braga, D Korn, JE Hochuli, KH Bowler, ... Journal of Chemical Information and Modeling 60 (8), 4056-4063, 2020 | 23 | 2020 |
Allosteric binders of ACE2 are promising anti-SARS-CoV-2 agents JE Hochuli, S Jain, C Melo-Filho, ZL Sessions, T Bobrowski, J Choe, ... ACS Pharmacology & Translational Science 5 (7), 468-478, 2022 | 4 | 2022 |
Discovery of Potential GSK-3β Allosteric Modulators for Alzheimer’s Disease GM Silva, VM Alves, SQ Gomes, JE Hochuli, E Muratov, A Tropsha, ... | | 2023 |
Novel Pharmacokinetics Profiler (PhaKinPro): Model Development, Validation, and Implementation as a Web-Tool for Triaging Compounds with Undesired PK Profiles M Rath, J Wellnitz, HJ Martin, C Melo-Filho, J Hochuli, GM da Silva, ... | | 2023 |
Allosteric binders of ACE2 are promising anti-SARS-CoV-2 agents (preprint) JE Hochuli, S Jain, C Melo-Filho, Z Sessions, T Bobrowski, J Choe, ... | | 2022 |
Visualizing convolutional neural network scoring of protein-ligand binding J Hochuli, A Helbling, M Ragoza, D Koes ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |