Journal of chemical information and modeling
Apr 13, 2020
The viscosities of pure liquids are estimated at 25 °C, from their molecular structures, using three modeling approaches: group contributions, COSMO-RS σ-moment-based neural networks, and graph machines. The last two are machine-learning methods, whe...
Proceedings of the National Academy of Sciences of the United States of America
Jan 16, 2018
Protocell models are used to investigate how cells might have first assembled on Earth. Some, like oil-in-water droplets, can be seemingly simple models, while able to exhibit complex and unpredictable behaviors. How such simple oil-in-water systems ...
A lab-made magnetic-mechanical robotic (MMR) system coupled to a flow-batch analyzer (FBA) for magnetic nanoparticles solid phase extraction (MSPE) is presented. As an illustrative application, an NMR-FBA couple was connected to a graphite furnace at...
Biological activities observed in living systems occur as the output of which nanometer-, submicrometer-, and micrometer-sized structures and tissues non-linearly and dynamically behave through chemical reaction networks, including the generation of ...
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