Pre-trained molecular representations enable antimicrobial discovery
Pre-trainingDataset: The MolE pre-training dataset was created by randomly sampling 100,000 unlabeled molecules from a collection of 10,000,000 unique structures...
Molecular
Experiments provide evidence that interaction of light with a hydrocarbon molecule produces strained molecular rings
A gas-phase X-ray scattering experiment captures cyclopentadiene rapidly transforming into the strained bicyclopentene. This structure change is triggered by a...
Green Chemistry: Pioneering Sustainable Molecular Design
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