Molecular Modeling Software: Description and product categories

Discover a world of possibilities in your flavor or fragrance research

Welcome to 2RM Technology. Our company developed the first program to predict flavor and taste thresholds in beverages and other matrices. Our program is incorporated into a molecular modeling program providing 100s of descriptors of fragrance and flavor molecules. We provide technical support and assist in your applications. If interested please leave a comment!

Example of MMP Scent Database used with Molecular Modeling Pro Flavor Plus (MMP)

Input to MMP with SMILES Notation): CC=CC(=O)C1C(C)=CCCC1(C)C

MMP Calculates 5 Structural Variables. Variables are input for MMP Scent

MMP Scent Calculates 3 structure increments that are compared to the MMP Scent Database

Two compound Hits are found: Alpha Damascone and Isodamascone. Both of formula C 13 H 20 O 1

Based on the graphic structure in MMP the SMILES structure best matches Alpha Damascone.

Output: Alpha Damascone,/ C 13 H 20 O /Scent: apple, rose, black currant, plum Odor threshold from MMP – 0.09 to 0.2 ppb.

Pro Flavor Plus Chemicaelectrica Gateway

Program capabilities

Calculates flavor and odor thresholds (ODT) from molecular structure (MDL molefile, SMILES, Macromodel file)

ODT in air, water and a variety of solvents/matrices (can be user defined)

Compare ODT values to those predicted by Abraham (2012) and Nagata (2003)

Calculate odor profiles in time/distance  

– Draw 3D chemical structures with an easy to use interface

– Minimize geometry and change conformation

– Calculates over 100 chemical properties from structure.   Assists in creating MSDS sheets. 

– Create Databases (Excel and ACCESS)

– Free solvent and surfactant structure database provided with software

This program was previously sold as Flavor, Fragrance and Odor Simulator and has been recently updated. 

NEW-MMP Scent Database

Provides Odor Profiles of over 4000 chemicals.

Predicts odor profiles of unknown flavor and fragrances from MMP Flavor Plus

Flavor and fragrance molecular design. Visit Design of Flavor and Fragrance post page

Price MMP Flavor Plus -Inquire

email- rsturkg@gmail.com or txt 508-269-4802

Japan- Gen-Scent Research Laboratory www.gen-scent.com

ChemicaElectrica Gateway

Program capabilities

ChemicaElectrica Gateway is intended to be a general-purpose Chemistry program functional in the internet age and convenient for connecting to A. I.. We have especially focused on making the program as flexible as possible by allowing the user to be able to modify almost everything. The program has four key components: a large database of molecules, user modifiable menus, substructure and similarity searching, and a 3-D drawing window.

-For teachers and students: link the curriculum to the menus and icons, create databases of the compounds, reactions and pathways covered in the lessons, and have the capability of linking it all to what is available on the internet.

-For researchers: perform substructure searches of the database, then with one click bring up the molecules found in the search in vendor catalogs, Wikipedia pages or the web pages of the US government.

Price: Free with purchase of Molecular Modeling Pro Flavor Plus

Links to Applications

Upcoming 2025 – Joint International Symposium of Kyoto Biomolecular Mass Spectrometry Society and NioIN Society for Natural Aroma

Abstract_NioIN Abstract_NioIN Society for Natural Aroma Society for Natural Aroma

P09_NioIN 2025

(Please inquire for more information on these materials and recent NioIN 2025 Poster)

email- rsturkg@gmail.com or txt 508-269-4802

Special Discounts for University researchers and students are available!