Papers matching “computational methods” 2,863
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CAT-COSMO-CAMPD: Integrated in silico design of catalysts and processes based on quantum chemistry2021 Computers & Chemical Engineering article Environmental Science Chemistry and Chemical Engineering Open access
Christoph Gertig, Lorenz Fleitmann, Carl Hemprich, Janik Hense, André Bardow, Kai O. Leonhard
11citations -
Analyzing Carrier Density and Hall Mobility in Impurity‐Free Silicon Virtually Doped by External Defect Placement2024 Advanced Functional Materials article Engineering Advancements in Semiconductor Devices and Circuit Design
Soundarya Nagarajan, Ingmar Ratschinski, S. Schmult, S. Wirth, Dirk König, Thomas Mikolajick, +2 more
10citations -
Plant PhysioSpace: a robust tool to compare stress response across plant species2021 PLANT PHYSIOLOGY article Biochemistry, Genetics and Molecular Biology Bioinformatics and Genomic Networks Open access
Ali Hadizadeh Esfahani, Janina Maß, Asis Hallab, David Nevarez, Björn Usadel, Mark‐Christoph Ott, +2 more
7citations -
Why we should sample sparsely and aim for a higher target: Lessons from model‐based therapeutic drug monitoring of vancomycin in intensive care patients2020 British Journal of Clinical Pharmacology article Medicine Antibiotics Pharmacokinetics and Efficacy Open access
Tingjie Guo, Reinier M. van Hest, Lucas M. Fleuren, Luca F. Roggeveen, Rob J. Bosman, Peter H. J. van der Voort, +4 more
7citations -
A tomographic workflow to enable deep learning for X-ray based foreign object detection2022 Expert Systems with Applications article Engineering Industrial Vision Systems and Defect Detection Open access cited by 1 patent
Mathé T. Zeegers, Tristan van Leeuwen, Daniël M. Pelt, Sophia Bethany Coban, Robert van Liere, Kees Joost Batenburg
6citations -
Large language models for structured cardiovascular data extraction: a foundation for scalable research and clinical applications2025 European Heart Journal - Digital Health article Computer Science Machine Learning in Healthcare Open access
Wouter P M van der Loo, Viktor van der Valk, Tim van den Broek, Douwe E. Atsma, Marius Staring, Roderick W.C. Scherptong
5citations -
Early detection of combustion instabilities in liquid rocket engines: Assessment of statistical, recurrence, and fractal analyses for sub- and supercritical pressure conditions2024 International Journal of Spray and Combustion Dynamics article Engineering Combustion and flame dynamics
Jan Martin, Michael Börner, Wolfgang Armbruster, Justin Steven Hardi, Michael Oschwald
3citations -
Evolutionary Probability and Stacked Regressions Enable Data-Driven Protein Engineering with Minimized Experimental Effort2024 Journal of Chemical Information and Modeling article Biochemistry, Genetics and Molecular Biology Protein Structure and Dynamics
Alexander-Maurice Illig, Niklas E. Siedhoff, Mehdi D. Davari, Ulrich Schwaneberg
3citations -
Tree-based learning on amperometric time series data demonstrates high accuracy for classification2024 International Journal of Data Science and Analytics article Computer Science Time Series Analysis and Forecasting Open access
Jeyashree Krishnan, Zeyu Lian, Pieter E. Oomen, Mohaddeseh Amir-Aref, Xiulan He, Soodabeh Majdi, +2 more
2citations -
Computer-Interpretable Quality Indicators for Intensive Care Medicine: Development and Validation Study2025 Journal of Medical Internet Research article Health Professions Electronic Health Records Systems Open access
Falk von Dincklage, Viktor Bublitz, Oliver Kumpf, Carlo Jurth, Reimer Rießen, Maria Deja, +6 more
2citations