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About

ESPResSo, the Extensible Simulation Package for Research on Soft Matter, is a highly versatile open source simulation package for performing and analyzing scientific molecular dynamics and Monte Carlo many-particle simulations. It is designed as a universal tool for simulating a variety of soft matter systems, especially coarse-grained atomistic or bead-spring models used in physics, chemistry, molecular biology, and process engineering. ESPResSo can be used to simulate polymers, liquid crystals, colloids, polyelectrolytes, ferrofluids, gels, biological systems, DNA, lipid membranes, bacterial motion, and super-capacitors. In coarse-grained models, a group of atoms or molecules is treated as a single bead, allowing researchers to investigate larger time and length scales than would be practical with fully atomistic simulations. ESPResSo supports classical molecular dynamics simulations in different statistical ensembles.

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

Physicists, chemists, biophysicists, and developers who need a Python-controlled package for coarse-grained molecular dynamics

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

ESPResSo
United States
espressomd.org/wordpress/

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
MFiX

MFiX

National Energy Technology Laboratory
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
Python
ZEMA Suite

Integrations

Enverus
ICE Connect
Kubernetes
Microsoft Excel
Microsoft Power BI
Morningstar
Python
ZEMA Suite
Claim ESPResSo and update features and information
Claim ESPResSo and update features and information
Claim Molecule and update features and information
Claim Molecule and update features and information