Physical chemistry – Page 6
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ResearchVacuum-field catalysis could change chemistry – but reproducibility concerns linger
Excitement about light–matter coupling results, tempered by lack of agreed-upon mechanism and difficulties reproducing results
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OpinionNavigating the literature torrent
It’s humanly impossible to filter and read everything worthwhile – let’s embrace assistance
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Research86-year old Hammett equation gets a machine learning update
Algorithm opens the door to improved understanding of aromatic substituent effects
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WebinarUsing crystallographic structures & data-driven solutions to advance drug design
Learn how structural data can be used to empower molecular discovery at each stage of the drug design pipeline
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ResearchFluorinated ligands stabilise perovskite solar cells
Findings offer new insight into how coatings interact with perovskites
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ResearchCrystal structure prediction tool a ‘significant and thought-provoking advance’
Algorithm needs just the chemical formula to find the ground state of a crystalline compound
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ResearchVan der Waals crust behind simple parameter that can describe chemical bonds
Penetration index provides a fresh perspective on two-atom interactions
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ResearchAI can suggest Covid-19 antivirals from protein sequence alone
IBM model can also find molecules that bind at different sites on target proteins
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CareersWorking at the forefront of AI
Petrina Kamya’s curiosity has led her across sectors to become a leader in drug discovery
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ResearchHalf-century quest to create stable beryllium–beryllium bond ends in success
Organoberyllium sandwich compound should provide answers to questions first posed a century ago
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ResearchHand-built caesium-based ‘artificial atoms’ used to create ‘synthetic’ benzene
Manufactured atoms offer chemists chance to play ‘mind games’ with matter and change bond order of molecules
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ArticleA three step strategy to make your research more sustainable
How chemistry data can make your reactions greener
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OpinionHow van der Waals first linked liquids and gases
150 years ago, a doctoral thesis changed our understanding of matter
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ResearchIdentifying single atoms with x-ray specificity
Combining synchrotron x-rays with scanning tunnelling microscopy gives atomic resolution
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WebinarCutting-edge cosmetics: innovating for sustainability with machine learning & molecular simulations
Learn how to save cost, reduce time and drive innovation in developing sustainable cosmetic formulations
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ResearchNew neural networks calculate catalysts’ adsorption energy ‘with lightning-fast speed’
AI has been used to overcome the problems of modelling massive molecules on metal surfaces, which could accelerate the design of efficient catalysts
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ResearchStudy untangles friction and surface chemistry in chemically damaged hair
Researchers develop system that can be used to screen the tribological performance of hair care formulations
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OpinionOrganic chemists should place their trust in machine learning’s black box
Submitting to the higher power of abstraction can strengthen our insights
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OpinionScientific authorship in the time of ChatGPT
With AI-generated texts here to stay, we need to recognise that intellectual work is much more than just writing