Molecular structure analysis of new fragrance components for the food industry using 'Gaussian'
Gaussian
Cutting-edge electronic state calculation technology to support flavor design.
In the food industry, particularly in fragrance design, it is essential to understand the relationship between molecular structure and scent, requiring precise calculations to create new fragrances. Grasping the molecular-level behaviors related to the quality, persistence, and safety of scents is crucial for high-quality fragrance development. The chemical calculation software 'Gaussian' provides cutting-edge methods and technologies to meet these needs. 【Application Scenarios】 - Molecular structure analysis of new fragrance components - Physical property prediction of existing fragrances - Stability evaluation of fragrances - Elucidation of scent mechanisms 【Benefits of Implementation】 - Increased efficiency in fragrance development - Discovery of new scents - Improvement in product quality - Reduction in research and development costs
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basic information
【Features】 - High-speed processing through GPU-based parallel computation - Support for new DFT functionals (M08HX, MN15, MN15L, PW6B95, PW6B95D3) - Non-harmonic vibration analysis functions such as DCPT2 and HDCPT2 methods - Support for NBO7 - Extensibility via Python interface □ List of Functions □ (Visit the HyLinks page) https://www.hulinks.co.jp/software/gaussian/#function
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□Request a Quote Here□ (Go to the Hyulinks page) https://www.hulinks.co.jp/software/gaussian/#price
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Applications/Examples of results
There are numerous implementation results in university and corporate research departments. It operates not only on cluster servers and supercomputers but also in cases where it is implemented on desktop servers. □ Please take a look at the catalog □ - General-purpose quantum chemistry calculations / pre-post programs 'Gaussian/GaussView' - Detailed version of Gaussian_GaussView
Line up（1）
| Model number | overview |
|---|---|
| GaussView 6 | https://www.hulinks.co.jp/software/gaussview/ |
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Company information
Even in a rapidly changing world, the philosophy of HuLinks has not changed since its founding. The greatness of humanity lies in our ability to think, create, and carve out a new tomorrow. We aim to contribute to society by providing carefully selected solutions that support this remarkable human ability—intellectual creation—while also offering a more comfortable environment and enhancing productivity.
