November 28, 2024 article Open access A graph neural network-state predictive information bottleneck (GNN-SPIB) approach for learning molecular thermodynamics and kinetics Digital Discovery DOI: 10.1039/d4dd00315b Full text (OA) OpenAlex Authors 0 Author list not loaded yet. Cited by 0 stored of 18 References 1 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 Effective data-driven collective variables for free energy calculations from metadynamics of paths 2024 PNAS Nexus article Biochemistry, Genetics and Molecular Biology Protein Structure and Dynamics Open access 11 citations 1 result