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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

Molecule is the modern ETRM/CTRM alternative to the complex systems of the past. Molecule is cloud-native and provides an easy-to-use experience, near real-time reporting, 30-plus integrations, and headache-free implementations. Molecule provides next-generation P&L, and near real-time VaR and position reporting for companies that trade any kind of commodity. Molecule can be used for power, natural gas, crude oil, renewables, biofuels, liquids, metals, agricultural products, softs and FX futures/options. Molecule is everything an ETRM should be. • Automatic deal capture • Automatic Market Data • Automatic position, P&L and near real-time VaR • Customized and advanced reporting with an embedded BI Tool • Automatic FCM reconciliation • ISO connectivity for FTRs and virtuals • Connectivity to multiple exchanges, market data providers and other sources • Fund allocations

API Access

Has API

API Access

Has API

Screenshots View All

Screenshots View All

Integrations

Enverus
ICE Connect
Kubernetes
Microsoft Excel
Microsoft Power BI
Morningstar
ZEMA Suite

Integrations

Enverus
ICE Connect
Kubernetes
Microsoft Excel
Microsoft Power BI
Morningstar
ZEMA Suite

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

Molecule

Founded

2012

Country

United States

Website

www.molecule.io

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

Commodity Trading and Risk Management (CTRM)

Accounting Management
Blockchain Technology
Commodity Trading
Contract Management
Document Management
Financial Management
Logistics Management
Reporting/Analytics
Risk Management
Third Party Integration

Energy Trading and Risk Management (ETRM)

Accounting Management
Asset Analysis
Blockchain Technology
Contract Management
Document Management
Energy Trading
Financial Management
Product Scheduling
Reporting/Analytics
Risk Management
Third Party Integration
Trade Validation

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