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What is MolKraft?

MolKraft is an innovative online tool tailored for the design, analysis, and documentation of molecular structures in chemistry. Its intuitive 2D editor allows users to seamlessly transform chemical structures into engaging 3D models, featuring detailed measurements and visualizations of molecular surfaces. The platform boasts an extensive array of capabilities, including a robust chemical library, a periodic table, molecular property calculations, assessments of formal charges, identification of stereocenters, InChI generation, calculations for reaction quantities, equation balancing, and evaluations of atom economy. The free version offers approximations for 1H and 13C NMR shifts based on established increment rules, while those who subscribe gain access to premium features such as specialized models for additional nuclei, on-device IUPAC naming, pKa estimations, molecular orbital analyses, image-to-structure conversion, and support for complex multi-step reaction pathways. Users can easily export their molecular structures and illustrations for integration into academic reports and publications, ensuring compliance with specific journal formatting requirements. Catering to a wide range of users, including chemistry students, educators, researchers, and industry professionals, MolKraft is utilized across educational institutions, research facilities, and corporate settings. Furthermore, its operation entirely within a web browser negates the need for software installation, significantly improving accessibility for all users and allowing for effortless collaboration and sharing of molecular designs. This makes MolKraft not only a versatile educational resource but also a valuable tool for professional use in the field of chemistry.

What is BIOVIA TURBOMOLE?

BIOVIA TURBOMOLE is a cutting-edge software suite designed for quantum chemistry, focusing on ab initio electronic structure calculations applicable to diverse systems like molecules, clusters, periodic structures, and solutions. Initially created at the University of Karlsruhe and Forschungszentrum Karlsruhe GmbH, it is now overseen by TURBOMOLE GmbH, which has broadened its functionality to encompass a variety of computational techniques, including density functional theory (DFT), Møller–Plesset perturbation theory, coupled-cluster methods, and GW-Bethe–Salpeter approaches. The software is particularly notable for its accuracy in predicting outcomes related to chemical reactions, spectroscopy, and the simulation of optical devices. Among its standout features are the optimization of reaction pathways, identification of transition states, and the modeling of solvation effects using COSMO-RS. Furthermore, its spectroscopic capabilities span a multitude of methods such as IR, Raman, VCD, UV-Vis, and vibronic spectra, while its optical property simulations are bolstered by advanced techniques for spin-orbit coupling and relativistic all-electron calculations. As a result, BIOVIA TURBOMOLE proves to be an invaluable tool for researchers delving into intricate chemical systems and their underlying properties, paving the way for innovative discoveries in the field of quantum chemistry. With its comprehensive range of features, it continues to be a cornerstone for academics and industry professionals alike.

Media

Media

Integrations Supported

Microsoft PowerPoint
Microsoft Word

Integrations Supported

API Availability

API Availability

Pricing Information

$0
MolKraft offers a free plan and a 14-day trial of every feature. Academic licenses cost $49/year; Professional licenses cost $149/year or $15/month; Lab licenses cost $1,299/year for up to 10 seats; school licenses cost $99/teacher/year; and campus licenses start at $600/year. Prices in India are listed in rupees and are subject to GST. During the private beta, paid prices are suggested, and payments are scheduled to open at public launch.
Free Version
Free Trial Offered?

Pricing Information

Pricing not provided

Supported Platforms

SaaS

Supported Platforms

Windows
Mac
Linux

Customer Service / Support

Web-Based Support

Customer Service / Support

Standard Support
24 Hour Support
Web-Based Support

Training Options

Documentation Hub

Training Options

Documentation Hub
Webinars
Online Training
On-Site Training

Company Facts

Organization Name

Mehra Holdings

Date Founded

1992

Company Location

India

Company Website

molkraft.com

Company Facts

Organization Name

Dassault Systèmes

Date Founded

1981

Company Location

France

Company Website

www.3ds.com/products/biovia/turbomole

Categories and Features

Molecular Modeling

Not specified

Categories and Features

Chemical

Not specified

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