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Materials
Design's MedeA environment helps researchers to access the powerful VASP
code for abintio calculations. Complementary to VASP there are very powerful
codes like MT for predicting mechanical and thermomechanical properties
of high-performance alloys, hard materials, oxides and other more complex
materials, Gibbs for Thermodynamic properties of solid-gas systems, liquids
and liquid-gas phases and Phonon for predicting lattice vibrational spectra
and thermodynamic functions for a wide range of materials. In fact there
are several more programs in the environment which could be useful.
Accelrys
(NASDAQ:ACCL), a leading scientific enterprise R&D software and services
company, supports industries and organizations that rely on scientific innovation
to differentiate themselves. Accelrys’ Enterprise R&D Architecture, built
on the industry leading Pipeline Pilot™ platform, enables customers to access,
organize, analyze and share scientific data in unprecedented ways, ultimately
enhancing innovation, improving productivity and compliance, reducing costs
and speeding time from lab to market.
Molecular
Networks delivers Chemoinformatics innovations by increasing the quality
and productivity of discovery in chemical, pharmaceutical and biotechnology
R&D. The company offers solutions in Hazard and Risk Assessment, Drug
Design and Property Prediction, Synthesis Design and Reaction Prediction,
Metabolic Engineering and White Biotechnology, Analysis and Prediction of
Metabolism and Building and Enriching Chemical Databases.
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