Odor thresholds are predicted from the FFOS model. The model is based on geometric, molecular, dynamical and thermodynamic factors that influence molecular properties on interaction with the odor receptors.
The model only requires input of the molecule as an energy minimized structure provided in the program, boiling point and density if available, otherwise these properties are also calculated in the program. The output is an odor threshold value given as a minimum and maximum range of values. The values are given both in air and liquid.
For further details and pricing:
Contact rsturkg@gmail.com
Applications: custom fragrances and flavors, stability, volatile diffusion, new flavor/fragrance molecular simulation.
If interested, please inquire for more information
Look at the Flavor Receptor Ellipsoid Model:
Preview the MMP program:
Molecular Modeling Pro Flavor Plus_
Rotational/Translational Factor (example): RT Factors quantify molecular functionality and measure hydrophilic and hydrophobic character.
Other Software- ChemicaElectrica Gateway and Chemsite. Inquire for details.
Customers: Major international fragrance producers, Flavor and beverage products companies, consumer products companies, Government agricultural and Environmental agencies.
In Japan contact: www.gen-scent.com