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About

GROMACS is a free and open source suite for high-performance molecular dynamics and output analysis. It is a versatile package for simulating the Newtonian equations of motion for systems with hundreds to millions of particles, with a strong focus on materials modeling, biomolecular simulation, and particle-based systems. GROMACS is primarily designed for biochemical molecules such as proteins, lipids, and nucleic acids, which involve many complicated bonded interactions, but its speed in calculating nonbonded interactions also makes it useful for non-biological systems such as polymers and other materials. It can model ensembles of particles in liquid, solid, or gaseous states and supports a wide range of molecular dynamics workflows, from basic energy minimization and equilibration to production simulations and detailed trajectory analysis.

About

Molecule is the modern, reliable ETRM/CTRM. Built in the cloud with an intuitive, easy-to-use experience at its core, Molecule is the alternative to the convoluted systems of the past. With near real-time reporting, 30+ integrations, and headache-free implementations, Molecule gets your ETRM/CTRM out of your way - because you have more valuable things to do with your time. Molecule is next-generation P&L, near real-time VaR, position, and risk reporting software for companies trading any kind of commodity. Molecule is designed for power, natural gas, crude, renewables, liquids, metals, ags, softs, and FX options/futures. Molecule is everything an ETRM should be: • Automatic deal capture • Automatic market data • Automatic position, P&L, near real-time VaR, and risk • Advanced and custom reporting with an embedded BI tool • Automatic FCM reconciliation • ISO connectivity for FTRs & virtuals • Connections to multiple exchanges and market data providers • Fund allocation

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

Computational chemists, biophysicists, materials scientists, and molecular simulation researchers who need a tool to model biomolecules and particle systems

Audience

Organizations and companies requiring an energy trading and risk management solution to keep track of their processes

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

Free
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

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

Review this Software

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

GROMACS
United States
www.gromacs.org

Company Information

Molecule
Founded: 2012
United States
www.molecule.io

Alternatives

Alternatives

AEGIS CTRM

AEGIS CTRM

AEGIS Hedging Solutions
NAMD

NAMD

Theoretical and Computational Biophysics Group
Igloo

Igloo

Brady Technologies
Fusion CTRM

Fusion CTRM

Fendahl International DWC
LIGGGHTS

LIGGGHTS

CFDEM
HydraX

HydraX

Hydra X

Categories

Categories

Commodity Trading and Risk Management (CTRM) Features

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) Features

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

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
Claim GROMACS and update features and information
Claim GROMACS and update features and information
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