Hans Matter - RankMe

12 papers Journal 12

Year	Rank	Type	Title / Venue / Authors
2025	J	`jnl`	Upgrading Reliability in Molecular Property Prediction by Robust Quantification of Uncertainty from Machine Learning Models. J. Chem. Inf. Model. Alex Kötter, Kanishka Singh, Hans Matter, Gerhard Hessler, Christoph Grebner
2024	J	`jnl`	Many-Shot In-Context Learning for Molecular Inverse Design. CoRR Saeed Moayedpour, Alejandro Corrochano-Navarro, Faryad Sahneh, Shahriar Noroozizadeh, Alexander Koetter, Jiri Vymetal, Lorenzo Kogler-Anele, Pablo Mas, Yasser Jangjou, Sizhen Li, Michael Bailey, Marc Bianciotto, Hans Matter, Christoph Grebner, Gerhard Hessler, Ziv Bar-Joseph, Sven Jager
2023	J	`jnl`	Integrating Reaction Schemes, Reagent Databases, and Virtual Libraries into Fragment-Based Design by Reinforcement Learning. J. Chem. Inf. Model. Susanne Sauer, Hans Matter, Gerhard Hessler, Christoph Grebner
2022	J	`jnl`	Interpretation of Structure-Activity Relationships in Real-World Drug Design Data Sets Using Explainable Artificial Intelligence. J. Chem. Inf. Model. Tobias Harren, Hans Matter, Gerhard Hessler, Matthias Rarey, Christoph Grebner
2020	J	`jnl`	Impact of Different Automated Binding Pose Generation Approaches on Relative Binding Free Energy Simulations. J. Chem. Inf. Model. Daniel Cappel, Steven Jerome, Gerhard Hessler, Hans Matter
2020	J	`jnl`	Using Graph Databases to Investigate Trends in Structure-Activity Relationship Networks. J. Chem. Inf. Model. Hans Matter, Christian Buning, Dan Dragos Stefanescu, Sven Ruf, Gerhard Hessler
2019	J	`jnl`	Predictive Multitask Deep Neural Network Models for ADME-Tox Properties: Learning from Large Data Sets. J. Chem. Inf. Model. Jan Wenzel, Hans Matter, K. Friedemann Schmidt
2017	J	`jnl`	Thermodynamic Characterization of Hydration Sites from Integral Equation-Derived Free Energy Densities: Application to Protein Binding Sites and Ligand Series. J. Chem. Inf. Model. Stefan Güssregen, Hans Matter, Gerhard Hessler, Evanthia Lionta, Jochen Heil, Stefan M. Kast
2014	J	`jnl`	Quantum-mechanics-based molecular interaction fields for 3D-QSAR. J. Cheminformatics Ahmed M. El Kerdawy, Stefan Güssregen, Hans Matter, Matthias Hennemann, Timothy Clark
2013	J	`jnl`	Quantum Mechanics-Based Properties for 3D-QSAR. J. Chem. Inf. Model. Ahmed M. El Kerdawy, Stefan Güssregen, Hans Matter, Matthias Hennemann, Timothy Clark
2012	J	`jnl`	3D-QSAR Based on Quantum-Chemical Molecular Fields: Toward an Improved Description of Halogen Interactions. J. Chem. Inf. Model. Stefan Güssregen, Hans Matter, Gerhard Hessler, Marco Müller, K. Friedemann Schmidt, Timothy Clark
1999	J	`jnl`	Comparing 3D Pharmacophore Triplets and 2D Fingerprints for Selecting Diverse Compound Subsets. J. Chem. Inf. Comput. Sci. Hans Matter, Thorsten Pötter