
Formulations
Complex mixtures simulated at every scale, so a formulation behaves in production the way it did in the model.

Computational chemistry from quantum to mesoscale, for materials and formulations.
Simcenter Culgi is Siemens' multiscale computational chemistry software. It predicts the chemical and physical properties of materials, formulations and polymers from the molecular level to the macroscopic, for specialty chemicals, energy storage, pharmaceuticals, personal care and cosmetics.


Complex mixtures simulated at every scale, so a formulation behaves in production the way it did in the model.

Automated parameterisation for systems with dozens of species, from micro-emulsions to liposomes, with validated stability methods.

Multiscale digital twins of polymer formulations, from crystallisation kinetics to blend morphology, screened at scale on HPC.

Automated molecular generation to model stability, efficacy and toxicity of personal-care formulations under changing regulation.

Quantum to coarse-grained to continuum in one automated workflow, on HPC or cloud, with AI-tuned force fields.

Auto-mapped coarse-grained models, from Brownian to DPD, for reactive and charged systems, screened in seconds.

Phase-field simulation of polymer blends, diffusion and morphology, built in a drag-and-drop node interface.

Custom molecular dynamics workflows with auto-generated force fields for polymers, chemicals and formulations.

Ab-initio methods and the integrated NWChem package for solids and molecules at the quantum level.
Tailored solutions for your industry
Candidates screened virtually before synthesis.
Quantum results carried through to coarse-grained and continuum scales.
Stability, efficacy and toxicity assessed before the lab.

Siemens Simcenter Culgi fact sheet
PDF · 1.0 MB
Fact sheets, guides and eBooks from the Knowledge Center.
Computational chemistry software that simulates materials and formulations from quantum scale up to mesoscale.
Chemical, petrochemical, coatings, personal care and materials companies developing new formulations.
No. Many models run on a workstation, and larger studies scale to clusters.
Yes. We provide onboarding, training and application support with Siemens specialists.
Tell us what you are building and a NomuTech engineer will get in touch.