May 30, 2013 article Open access Open-source platform to benchmark fingerprints for ligand-based virtual screening Journal of Cheminformatics DOI: 10.1186/1758-2946-5-26 Full text (OA) OpenAlex Authors 0 Author list not loaded yet. Cited by 6 stored of 397 Search Sort Most cited Newest Oldest Patent citations Title Any typearticle review book-chapter conference-paper preprint dissertation book dataset other Any fieldAgricultural and Biological Sciences Arts and Humanities Biochemistry, Genetics and Molecular Biology Business, Management and Accounting Chemical Engineering Chemistry Computer Science Decision Sciences Dentistry Earth and Planetary Sciences Economics, Econometrics and Finance Energy Engineering Environmental Science Health Professions Immunology and Microbiology Materials Science Mathematics Medicine Neuroscience Nursing Pharmacology, Toxicology and Pharmaceutics Physics and Astronomy Psychology Social Sciences Veterinary Open access Predicting the Temperature Dependence of Surfactant CMCs Using Graph Neural Networks 2024 Journal of Chemical Theory and Computation article Chemistry Surfactants and Colloidal Systems Open access cited by 1 patent 21 citations AI is a viable alternative to high throughput screening: a 318-target study 2024 Scientific Reports article Computer Science Computational Drug Discovery Methods Open access 140 citations The openOCHEM consensus model is the best-performing open-source predictive model in the First EUOS/SLAS joint compound solubility challenge 2024 SLAS DISCOVERY article Computer Science Computational Drug Discovery Methods Open access 21 citations Artificial intelligence for natural product drug discovery 2023 Nature Reviews Drug Discovery review Computer Science Computational Drug Discovery Methods Open access 454 citations openOCHEM consensus model wins Kaggle First EUOS/SLAS Joint Compound Solubility Challenge 2023 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access 0 citations QSAR-derived affinity fingerprints (part 1): fingerprint construction and modeling performance for similarity searching, bioactivity classification and scaffold hopping 2020 Journal of Cheminformatics article Computer Science Computational Drug Discovery Methods Open access 50 citations 6 results References 0