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MQS REST-API

By: Molecular Quantum Solutions Latest Version: 0.0.1
Linux/Unix
Linux/Unix

Product Overview

The MQS REST-API allows the user to screen for chemicals in the permanent MQS database which consists of 210 million geometry optimized molecular structures.
Further, the user can send job calculations through the API to have solubility, viscosity and partition coefficient values calculated. Phase equilibria calculations are also supported including vapour-liquid-, liquid-liquid and solid-liquid-equilibria.
The API allows the user to perform a high-throughput screening of the molecules in the database to calculate the before mentioned properties and also to define new molecular structures.

Version

0.0.1

Operating System

Linux/Unix, Ubuntu 20.04

Delivery Methods

  • Amazon Machine Image

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