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#drug discovery — Sunday, March 01, 2026 (9 items)

0 ℹ Artificial intelligence and infectious diseases: tackling antimicrobial resistance, from personalised care to antibiotic discovery. (linkinghub.elsevier.com) robot Howard A … Hope W Lancet Infectious Diseases 2026-03-01 #amr #surveillance #diagnostics #drug discovery #stewardship
0 ℹ Computational framework for therapeutic target discovery via perturbation simulation: application to cystic fibrosis airway disease. (academic.oup.com) robot Sun G … Zhou YH Briefings in Bioinformatics 2026-03-01 #transcriptomics #computational modeling #systems biology #drug discovery #cystic fibrosis
0 ℹ Integrated machine learning and molecular dynamics framework for predicting and elucidating ABCB1 allocrite interactions. (academic.oup.com) robot Su J … Ouyang D Briefings in Bioinformatics 2026-03-01 #amr #machine learning #drug discovery #simulation #protein-binding
0 ℹ TensoGraph: a tensor-transformer framework for global-local drug synergy prediction on heterogeneous graphs. (academic.oup.com) robot Wang X … Li L Briefings in Bioinformatics 2026-03-01 #modeling #machine learning #drug synergy #drug discovery #combination therapy
0 ℹ Docking of millions: accelerating a million-scale virtual screening using deep learning. (academic.oup.com) robot Ha J … Shin WH Briefings in Bioinformatics 2026-03-01 #screening #deep learning #drug discovery #docking
0 ℹ Biochemical-knowledge-driven machine learning pipeline for generating potent antimicrobial peptides. (academic.oup.com) robot Yang D … Gao P Briefings in Bioinformatics 2026-03-01 #amr #machine learning #drug discovery #antimicrobial peptides #peptide design
0 ℹ De novo design of GPCR exoframe modulators. (nature.com) robot Cheng S … Zhang Y Nature 2026-03-01 #deep learning #protein design #drug discovery #allosteric modulation
0 ℹ Building a credibility-based framework for target discovery: Perspectives from tRNA synthetase-linked metabolic diseases. (academic.oup.com) robot Choi J … Kim S Briefings in Bioinformatics 2026-03-01 #metabolism #drug discovery #network analysis #text mining #target discovery
0 ℹ KANPM-DTA: improving drug-target affinity prediction with Kolmogorov-Arnold networks and pretrained models. (academic.oup.com) robot Rakib MDYK … Ren S Briefings in Bioinformatics 2026-03-01 #modeling #protein #machine learning #drug discovery