BioSolveIT offers cutting-edge software solutions for drug discovery, with SeeSAR and infiniSee platforms to support both structure-based and ligand-based approaches, empowering chemists to accelerate their research and gain valuable insights from computational results with ease.
When seeking high predictivity in simulating fluid-phase chemical processes, our solutions, rooted in cutting-edge quantum chemistry and thermodynamics, utilize the advanced COSMO-RS theory, an algorithm that calculates chemical potential differences to derive crucial properties like solubilities, activities, and vapor pressures.
CDD Vault streamlines data management, analysis, and presentation for research teams, offering an intuitive, web-based interface that prioritizes simplicity, collaboration, and security, in contrast to bulky and error-prone software often found in scientific applications.
Chemcraft, a versatile graphical software for quantum chemistry computations, offers an efficient solution for visualizing results and setting up new calculations. Compatible with popular QC packages including Gaussian, Orca, Molpro, ADF, Dalton, NWChem, GAMESS-US, and more, it simplifies workflow and enhances compatibility through seamless atom coordinate import/export, making it an invaluable tool for researchers.
Founded in 1996 as a spin-off from the University of Wisconsin-Madison, CompuTherm LLC has emerged as a top developer of thermodynamic and phase diagram calculation software and kinetic simulations using the CALPHAD approach. With its renowned Pandat software and extensive alloy system databases, CompuTherm empowers researchers globally to drive alloy design and development, making it a leading choice among hundreds of professionals worldwide
Optibrium offers sophisticated software solutions for small molecule design, optimization, and data analysis, enhancing decision-making and efficiency in drug discovery. Our ongoing commitment to innovation results in the development of cutting-edge products and pioneering technologies, aimed at streamlining and boosting productivity in the drug discovery process. Collaborating closely with a diverse range of customers, including prominent global pharmaceutical, biotech, agrochemical, and flavoring companies, as well as not-for-profit and academic groups, we are dedicated to driving advancements in the field.
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