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ease
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Average Ratings 0 Ratings

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ease
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support

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Description

BIOVIA COSMOtherm represents a sophisticated implementation of COSMO-RS that merges principles of quantum chemistry with thermodynamics to forecast the thermodynamic characteristics of liquid substances. It computes the chemical potential of molecules in both pure and mixed liquids at varying temperatures, thus allowing for the estimation of various properties including solubility, partition coefficients, vapor pressures, and phase diagrams. In contrast to other approaches, COSMOtherm utilizes thermodynamically consistent equations to derive properties as a function of concentration and temperature, which enhances its accuracy. This tool is capable of predicting the solubility of liquids, solids, and gases, as well as providing values for activity coefficients, two-phase partitioning such as LogP, phase behavior, vapor pressures, free energy of solvation, pKa, energy of transfer to liquid-liquid interfaces, micellar and membrane partitioning, and interfacial tension. Additionally, COSMOtherm is equipped with a user-friendly graphical interface alongside a command-line version, facilitating smooth integration into pre-existing workflows, making it a versatile choice for researchers in the field. Its comprehensive capabilities make it a valuable asset for those seeking to understand complex liquid systems more thoroughly.

Description

As a member of the DeepMatter Group, we persist in providing our advanced platforms for Synthesis & Reaction Prediction, Information Extraction, Cheminformatics, and the groundbreaking DigitalGlassware®, which is a cloud-based digital chemistry solution from DeepMatter™ that enhances recordability, reproducibility, and shareability throughout every phase of the discovery journey, from the initial planning of reactions to the final analysis of results. Our collaboration with clients and users remains strong as we develop innovative software solutions designed to elevate chemical research and refine scientific workflows. DeepMatter boasts a diverse range of products that significantly speed up and enhance the processes of hypothesis generation, design, and synthesis. By utilizing these tools, new compounds—including pharmaceuticals, agrichemicals, and performance chemicals—can reach the market more swiftly. Additionally, DigitalGlassware converts your chemistry into digital code, ultimately boosting laboratory productivity and efficiency in research endeavors. This fusion of technology and chemistry opens up new avenues for innovation and collaboration in the scientific community.

API Access

Has API

API Access

Has API

Screenshots View All

Screenshots View All

Integrations

Tribepad

Integrations

Tribepad

Pricing Details

No price information available.
Free Trial
Free Version

Pricing Details

No price information available.
Free Trial
Free Version

Deployment

Web-Based
On-Premises
iPhone App
iPad App
Android App
Windows
Mac
Linux
Chromebook

Deployment

Web-Based
On-Premises
iPhone App
iPad App
Android App
Windows
Mac
Linux
Chromebook

Customer Support

Business Hours
Live Rep (24/7)
Online Support

Customer Support

Business Hours
Live Rep (24/7)
Online Support

Types of Training

Training Docs
Webinars
Live Training (Online)
In Person

Types of Training

Training Docs
Webinars
Live Training (Online)
In Person

Vendor Details

Company Name

Dassault Systèmes

Founded

1981

Country

France

Website

www.3ds.com/products/biovia/cosmo-rs/cosmotherm

Vendor Details

Company Name

DeepMatter

Country

Germany

Website

www.deepmatter.io/about-us/infochem

Product Features

Chemical

Certificates of Analysis
Chemical Process Simulation
Computer-Assisted Structure Elucidation (CASE)
ISO Management
Inventory Management
Particle Tracking
Reporting & Statistics
Samples Tracking
Traceability
Uncertainty Analysis

Product Features

Chemical

Certificates of Analysis
Chemical Process Simulation
Computer-Assisted Structure Elucidation (CASE)
ISO Management
Inventory Management
Particle Tracking
Reporting & Statistics
Samples Tracking
Traceability
Uncertainty Analysis

Alternatives

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Torx

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BIOVIA COSMO-RS

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Reaxys Reviews

Reaxys

Elsevier
Aurora Drug Discovery Reviews

Aurora Drug Discovery

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BIOVIA COSMO-RS Reviews

BIOVIA COSMO-RS

Dassault Systèmes