Papers matching “computational methods” 2,863
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Generate what you can make: achieving in-house synthesizability with readily available resources in de novo drug design2025 Journal of Cheminformatics article Pharmacology, Toxicology and Pharmaceutics Computational Drug Discovery Methods Open access
Alan Kai Hassen, Martin Šícho, Yorick J. van Aalst, Mirjam C. W. Huizenga, Darcy N. R. Reynolds, Sohvi Luukkonen, +5 more
17citations -
An effective simulation- and measurement-based workflow for enhanced diagnostics in rhinology2021 Medical & Biological Engineering & Computing article Medicine Nasal Surgery and Airway Studies Open access
Moritz Waldmann, Alice Grosch, Christian Witzler, Matthias Lehner, Odo Benda, Walter Koch, +5 more
14citations -
gpuZoo: Cost-effective estimation of gene regulatory networks using the Graphics Processing Unit2022 NAR Genomics and Bioinformatics article Biochemistry, Genetics and Molecular Biology Gene Regulatory Network Analysis Open access cited by 1 patent
Marouen Ben Guebila, Daniel C. Morgan, Kimberly Glass, Marieke L. Kuijjer, Dawn Lisa DeMeo, John Quackenbush
8citations -
Hackathons as effective pedagogical tools in interdisciplinary biological training: report from two training programs for sub-Saharan African students2026 Journal of Biological Education article Engineering Biomedical and Engineering Education Open access
Marvin van Aalst, Tobias Pfennig, Faraimunashe Chirove, Marilyn Ronoh, Anna Matuszyńska
2citations -
Design and evaluation of semantically-valid negative samples integration techniques for scalable semi-automated drug repurposing prediction pipelines in rare disease research2citations
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Unlocking ultra-deep wide-field imaging with sidereal visibility averaging2025 Springer Link (Chiba Institute of Technology) article Physics and Astronomy Radio Astronomy Observations and Technology Open access
J.M.G.H.J. de Jong, Reinout J. van Weeren, Tammo Jan Dijkema, J. B. R. Oonk, Huub J. A. Röttgering, Frits Sweijen
0citations -
Sphenix : smoothed particle hydrodynamics for the next generation of galaxy formation simulations2021 Monthly Notices of the Royal Astronomical Society article Physics and Astronomy Galaxies: Formation, Evolution, Phenomena Open access
Josh Borrow, Matthieu Schaller, Richard G. Bower, Joop Schaye
78citations -
HGVS Nomenclature 2024: improvements to community engagement, usability, and computability2024 Genome Medicine article Biochemistry, Genetics and Molecular Biology Genomics and Rare Diseases Open access
Reece K. Hart, Ivo F.A.C. Fokkema, Marina T. DiStefano, Ros J. Hastings, Jeroen F. J. Laros, Rachel L. Taylor, +2 more
65citations