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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
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