Papers matching “computational methods” 2,863
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Neural Networks for Survival Prediction in Medicine Using Prognostic Factors: A Review and Critical Appraisal2022 Computational and Mathematical Methods in Medicine article Computer Science Machine Learning in Healthcare Open access
Georgios Kantidakis, Audinga‐Dea Hazewinkel, Marta F. Fiocco
18citations -
REMIX SPH – improving mixing in smoothed particle hydrodynamics simulations using a generalised, material-independent approach2025 Journal of Computational Physics article Engineering Fluid Dynamics Simulations and Interactions Open access
Thomas D. Sandnes, V. R. Eke, Jacob Kegerreis, R. Massey, Sergio Ruiz-Bonilla, Matthieu Schaller, +1 more
16citations -
GraphXForm: graph transformer for computer-aided molecular design2025 Digital Discovery article Pharmacology, Toxicology and Pharmaceutics Computational Drug Discovery Methods Open access
Jonathan Pirnay, Jan G. Rittig, Alexander Wolf, Martin Grohe, Jakob Burger, Alexander Mitsos, +1 more
15citations -
Large-Scale Modeling of Sparse Protein Kinase Activity Data2023 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
Sohvi Luukkonen, Erik Meijer, Giovanni A. Tricarico, Johan Hofmans, Pieter F. W. Stouten, Gerard J. P. van Westen, +1 more
14citations -
Successive Statistical and Structure-Based Modeling to Identify Chemically Novel Kinase Inhibitors2020 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
Lindsey Burggraaff, Eelke Bart Lenselink, Willem Jespers, Jesper E. van Engelen, Brandon J. Bongers, Marina Gorostiola González, +5 more
13citations -
System identification and artificial intelligent (AI) modelling of the molten salt electrolysis process for prediction of the anode effect2023 Computational Materials Science article Chemical Engineering Molten salt chemistry and electrochemical processes Open access
Ozan Kaya, Masoud Abedinifar, Dominic Feldhaus, Fabian Diaz, Şeniz Ertuğrul, Bernd G. Friedrich
12citations -
Cardiovascular imaging research and innovation in 20232024 European Heart Journal - Imaging Methods and Practice article Medicine Cardiac Imaging and Diagnostics Open access
Andrea Barison, Ana Teresa Timóteo, Riccardo Liga, Sonia Borodzicz-Jażdżyk, Saloua El Messaoudi, Christina L. Luong, +6 more
10citations -
Predictions of the Poses and Affinity of a Ligand over the Entire Surface of a NEET Protein: The Case of Human MitoNEET2023 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
Ke Zuo, Riccardo Capelli, Giulia Rossetti, Rachel Nechushtai, Paolo Carloni
8citations -
Local depletion of large molecule drugs due to target binding in tissue interstitial space2024 CPT Pharmacometrics & Systems Pharmacology article Computer Science Computational Drug Discovery Methods Open access
Tatiana Zasedateleva, Stephan Schaller, Elizabeth C. M. de Lange, Wilhelmus E. A. de Witte
8citations -
Recurrent Colorectal Liver Metastases in the Liver Remnant After Major Liver Surgery—IRE as a Salvage Local Treatment When Resection and Thermal Ablation are Unsuitable2021 CardioVascular and Interventional Radiology article Biochemistry, Genetics and Molecular Biology Microbial Inactivation Methods Open access
Lea Hitpaß, Martina Distelmaier, Ulf P. Neumann, Wenzel Schöning, Peter Isfort, Sebastian Keil, +3 more
8citations -
Efficient thermo-mechanically coupled and geometrically nonlinear two-scale FE-FFT-based modeling of elasto-viscoplastic polycrystalline materials2024 Computer Methods in Applied Mechanics and Engineering article Engineering Composite Material Mechanics Open access
Annika Schmidt, Christian Gierden, Rainer Fechte‐Heinen, Stefanie Reese, Johanna Waimann
7citations -
Multi-objective synthesis planning by means of Monte Carlo Tree search2025 Artificial Intelligence in the Life Sciences article Pharmacology, Toxicology and Pharmaceutics Computational Drug Discovery Methods Open access
Helen Lai, Christos C. Kannas, Alan Kai Hassen, Emma Granqvist, Annie M. Westerlund, Djork-Arné Clevert, +2 more
7citations -
Biosynfoni: a biosynthesis-informed and interpretable lightweight molecular fingerprint2025 Journal of Cheminformatics article Pharmacology, Toxicology and Pharmaceutics Computational Drug Discovery Methods Open access
Lucina-May Nollen, David Meijer, Maria Sorokina, Justin J. J. van der Hooft
6citations