Solution-state nuclear magnetic resonance (NMR) spectroscopy is the classical NMR spectroscopy approach used for molecular structure determination, where the experimental sample is studied while ...

Molecular machine learning (ML) underpins critical workflows in drug discovery, material science, and catalyst optimization ...

Rosie has always worked with a strong focus on analytical techniques, including SEM-EDS, EPMA-WDS, XRF and mass spectrometry. She is currently Business Manager for Magnetic Resonance and works with ...

Raman spectroscopy is an optical technique that detects intrinsic vibrational, rotational and other low-frequency modes in molecules upon inelastic scattering of monochromatic light. Because ...

Pfizer, Pharmacokinetics, Dynamics and Metabolism, Ann Arbor, Michigan 48015, Wyeth Pharmaceuticals, 500 Arcola Road, Collegeville, Pennsylvania 19426, Pfizer ...

† Key Laboratory of High Performance Polymer Materials and Technology (Nanjing University), Ministry of Eduction., Department of Polymer Science and Engineering, School of Chemistry and Chemical ...

Previous methods focus on extracting chronological features from diffusion paths and leverage relations in social graph as side information to facilitate diffusion prediction. However, abundant ...