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Home > Chemical > Graphical tool "ChemCraft" for visualization of molecular structure data

Graphical tool "ChemCraft" for visualization of molecular structure data

2021/9/28 TEGARA Co., Ltd. Mathematical Science, Chemical, engineering, Informatics, Multimedia (video / image / audio) processing, Business support and efficiency tools, Overseas Products What's New (Unipos)
■ This is an article posted on June 2021, 9, so the content of the information may be out of date.

Graphical tool for visualization of molecular structure data on Unipos website  ChemCraft Page has been added.

ChemCraftIs a graphical tool for quantum chemistry calculation program packages such as GAMESS (US), Firefly (PC GAMESS) and Gaussian.

 

Overview of ChemCraft

It has an advanced graphical user interface and practical features to divide the calculation results into the individual elements required for the program (such as geometry and vibration mode) and display them in a hierarchical multi-level list. Makes the output file more structured and visualized.This feature also makes it easy to analyze complex files such as scan jobs, IRC jobs, and multiple jobs.

Support for major packages

  • GAMESS (US), Firefly (PC GAMESS)
  • Gaussian94-09

Main functions

  • Rendering a 3D image of a molecule in atomic coordinates
    (Gamess, Gaussian, NWChem, ADF, Molpro, Dalton, Jaguar, Orca, QChem)
  • Visualization of output files of quantum chemistry calculation software
  • Tools for building molecules and changing molecular structures
  • Creating publishable images
  • Additional utilities for input files

System requirements

  • Windows 8, 10 (32bit / 64bit)
  • Linux (32bit / 64bit)

* but the Linux version has some disadvantages

Function example

Chemcraft interface:Hierarchical list and visualization of all available data (atomic coordinates, energy gradients, etc.) extracted from the output file of the quantum chemistry calculation software

 

Example of energy gradient visualization:Reliable visualization of computational data 

 

 

* For details click here Please refer to

 

About License

Chemcraft is a subscription license (8 years).

Free updates and user support are available for 8 years after purchase.
You can continue to use Chemcraft (excluding OS reinstallation) as long as the environment is the same even after 8 years.

License type:

  • commercial license
  • academic license

* Please contact us for organizational use (site license).

The Chemcraft installer is common to the trial version and the product version (click here to download).

  • Trial period: 150 days
  • Product version: Must be activated with a registration key within 10 months of purchase

 

■ Click here for product details and inquiries

ChemCraft | Graphical tools for molecular structure data visualization

Manufacturer (Programming, design, etc: Grigoriy Andrienko) WEB site

  • Quantum chemistry calculation
  • Gaussian
  • Structural analysis

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