September 12, 2019 article Open access BigSMILES: A Structurally-Based Line Notation for Describing Macromolecules ACS Central Science DOI: 10.1021/acscentsci.9b00476 Full text (OA) OpenAlex Authors 0 Author list not loaded yet. Cited by 3 stored of 352 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 Molecular machine learning in chemical process design 2026 Current Opinion in Chemical Engineering review Materials Science Machine Learning in Materials Science Open access 5 citations Proposal NFDI4Chem 2025-2030 In the National Research Data Infrastructure (NFDI) — Our Vision: All Chemists Publish FAIR Data 2025 Research Ideas and Outcomes article Computer Science Research Data Management Practices Open access 3 citations Sequential EXtreme Gradient Boosting-Based Descriptor Reduction for Size Prediction of Zwitterionic Polymer-Based Nanoparticles 2025 ACS Omega article Materials Science Machine Learning in Materials Science Open access 1 citations 3 results References 0