Molecular Modeling

ChemBio3D Ultra brings workstation-quality molecular graphics and rigorous computational methods to your desktop. Integration with molecular analysis makes ChemBio3D the ideal software for chemists and biochemists.

HyperChem is a sophisticated molecular modeling environment that is known for its quality, flexibility, and ease of use. Uniting 3D visualization and animation with quantum chemical calculations, molecular mechanics, and dynamics, HyperChem puts more molecular modeling tools at your fingertips than any other Windows program.

MestRe Nova makes NMR data processing, simulation and analysis a pleasure. All the tools you need are at your fingertips in a single, intuitive environment, and the program handles all the complex, technical aspects of the process for you. Select your FID and get automatically your spectra already processed.

Gaussian 09 is the latest in the Gaussian series of programs. It provides state-of-the-art capabilities for electronic structure modeling. All versions of Gaussian 09 contain every scientific/modeling feature, and none imposes any artifical limitations on calculations other than your computing resources and patience.

CrystalMaker is an award-winning program for building, displaying and manipulating all kinds of crystal and molecular structures - with real-time photo-realistic graphics and “out-of-the-screen” 3D display.

Cresset’s family of Fields-based tools provide you with a powerful new insight into the biological activity of your chemical compounds. Fields model the surface properties and shape of a compound (which determine its interaction with a target protein), and allow much more detailed analysis of how chemical structure relates to biological activity, whether or not you have a structure for your target.

GaussView is an advanced and affordable molecular builder and visualization program. GaussView is a graphical user interface designed to help you prepare input for submission to Gaussian and to examine graphically the output that Gaussian produces. GaussView serves as a front-end/back-end processor to aid in the use of Gaussian.