AQChemSim

AQChemSim

SandboxAQ
BIOVIA COSMO-RS

BIOVIA COSMO-RS

Dassault Systèmes
+
+

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About

AQChemSim is a cloud-native platform developed by SandboxAQ that leverages Large Quantitative Models (LQMs) grounded in physics and chemistry to revolutionize materials discovery and optimization. By integrating Density Functional Theory (DFT), Iterative Full Configuration Interaction (iFCI), Generative AI, Bayesian Optimization, and Chemical Foundation Models, AQChemSim enables high-fidelity simulations of molecular and material behaviors under real-world conditions. AQChemSim's capabilities include predicting performance under various stresses, accelerating formulation through in silico testing, and exploring sustainable chemical processes. Notably, AQChemSim has demonstrated significant advancements in battery technology by reducing lithium-ion battery end-of-life prediction time by 95%, achieving 35x greater accuracy with 50x less data.

About

BIOVIA COSMO-RS is a comprehensive toolbox for modeling and predicting fluid phase properties, enabling chemical engineers, chemists, formulation engineers, and materials scientists to research and develop new solutions faster and more efficiently than with test and experimentation alone, thus accelerating innovation and reducing costs. COSMO-RS simulations are based on a sound scientific theory, which ensures robust and reliable predictions over the whole range of chemistry in the liquid state. The first-principle approach allows for predictions of new, not yet synthesized compounds, reaching beyond the known chemical space. BIOVIA’s COSMO team consists of the original inventors of COSMO-RS, assuring timely support and prime expertise to help solve even the most challenging problems in solution thermodynamics. Key benefits include a robust scientific foundation combining quantum chemistry and thermodynamics to ensure accuracy and reliability.

Platforms Supported

Windows
Mac
Linux
Cloud
On-Premises
iPhone
iPad
Android
Chromebook

Platforms Supported

Windows
Mac
Linux
Cloud
On-Premises
iPhone
iPad
Android
Chromebook

Audience

Chemical engineers seeking to accelerate the discovery and optimization of advanced materials through high-accuracy, AI-driven simulations

Audience

Chemical engineers and formulation scientists searching for a tool to predict fluid phase properties accurately, facilitating faster development of innovative solutions across various industries

Support

Phone Support
24/7 Live Support
Online

Support

Phone Support
24/7 Live Support
Online

API

Offers API

API

Offers API

Screenshots and Videos

Screenshots and Videos

Pricing

No information available.
Free Version
Free Trial

Pricing

No information available.
Free Version
Free Trial

Reviews/Ratings

Overall 0.0 / 5
ease 0.0 / 5
features 0.0 / 5
design 0.0 / 5
support 0.0 / 5

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Reviews/Ratings

Overall 0.0 / 5
ease 0.0 / 5
features 0.0 / 5
design 0.0 / 5
support 0.0 / 5

This software hasn't been reviewed yet. Be the first to provide a review:

Review this Software

Training

Documentation
Webinars
Live Online
In Person

Training

Documentation
Webinars
Live Online
In Person

Company Information

SandboxAQ
Founded: 2021
United States
www.sandboxaq.com/solutions/aqchemsim

Company Information

Dassault Systèmes
Founded: 1981
France
www.3ds.com/products/biovia/cosmo-rs

Alternatives

AQBioSim

AQBioSim

SandboxAQ

Alternatives

BIOVIA COSMOtherm

BIOVIA COSMOtherm

Dassault Systèmes
BIOVIA TURBOMOLE

BIOVIA TURBOMOLE

Dassault Systèmes
BIOVIA Materials Studio

BIOVIA Materials Studio

Dassault Systèmes
BIOVIA

BIOVIA

Dassault Systèmes
Khimera

Khimera

Kintech Laboratory
Reaxys

Reaxys

Elsevier

Categories

Categories

Integrations

Amazon Web Services (AWS)

Integrations

Amazon Web Services (AWS)
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