Q-Chem: The Driving Force of Technological Innovation
Clarifying the behavior of pollutants in environmental analysis through computational chemistry.
Quickly identify relevant patents and literature by searching a large database of 256M substances using chemical structure formulas and CAS numbers.
Providing cutting-edge methods and technologies for electronic state calculations and computational chemistry models across a wide range of fields, including chemistry, biochemistry, and physics.
Chemical calculation software / Optimized to obtain high-precision large-scale DFT solutions, covering all functionalities.
Chemical calculation software / Capable of predicting non-equilibrium quantum transport of nanostructures including current-voltage characteristics of nanoscale devices.
Cutting-edge computational chemistry technology that accelerates new drug design.
Cutting-edge computational chemistry techniques that support research and development in the field of chemistry.
A cutting-edge electronic state calculation program that supports the exploration of new materials.
Cutting-edge computational chemistry technology that supports process optimization.
Cutting-edge computational chemistry technology that supports molecular design in the semiconductor field.
Cutting-edge electronic state calculations and computational chemistry models to accelerate battery material development.
Computational chemistry techniques that support molecular design in pesticide development.
Cutting-edge electronic state calculation technology to support flavor design.
Cutting-edge computational chemistry technology that supports the research and development of functional ingredients.
Cutting-edge electronic state calculation technology that supports the analysis of biomolecules.
A cutting-edge electronic state calculation program that supports automotive paint development.
Effective for predicting the vapor pressure of metal complexes used as precursors in ALD and CVD!
Analysis services using quantum chemistry calculations! We propose suitable plans tailored to the properties and applications you want to explore.
[L'Oréal Case] Molecular Dynamics and Coarse-Grained Simulations to Facilitate the Formulation Design of Eco-Friendly Cosmetics
[Japanese Flyer] Overview of Computational Chemistry Platform for Life Sciences, Drug Discovery, and Biotechnology
There are many modules for arranging solvent water molecules and neutralizing the system! It is also possible to refine NMR structures.
New modeling performance of TD-DFT analysis, such as second derivatives! Computational performance and usability have been enhanced.
Create practically meaningful and stable conformational isomers! Achieve efficient conformational space exploration.
By adopting a coarse-grained model and a four-body potential, we significantly reduce computational costs and achieve fast evaluations.
HPC for those conducting material property prediction and analysis, as well as chemical reaction analysis, using quantum chemistry calculation software.