Chem3D Ultra 5.0
Chem3D Ultra 5.0 brings workstation quality molecular surface graphics and intense calculation methods to your desktop computer. Tight integration with a number of molecular analysis packages and a built-in calculation setup environment make Chem3D the ideal front-end to your molecular modeling and analysis needs.
The latest release of Chem3D provides a Gaussian client interface to set up jobs for Gaussian 98W/98M. Compute surface areas and molecular volumes using the Connolly Surface algorithms. Also predict advanced physical properties such as LogP, solubility, molar refractivity and more. Compute partial atomic charges using MOPAC or Huckel calculations. Visualize and superimpose molecular orbitals, electrostatic potentials, charge densities, spin densities and solvent accessible surfaces. Release 5.0 has remodeled the graphical user interface into a unified window which allows customization of the modeling, table and message areas. Extra export formats include: 3DMF, TIFF, BMP and PNG.
Chem3D Ultra includes:
 ChemDraw Std 5.0
- ChemDraw Net Plugin 5.0
- Chem3D Pro 5.0
- Chem3D Std Plugin 4.0
- ChemFinder Pro 5.0
Chem3D Ultra includes the following ADD-INS:
- ChemProp Predict BP, MP, Critical Temp., Critical Pressure, Gibbs Free Energy, logP, Refractive Index, Heat of Formation, and more from a ChemDraw structure.
- MOPAC Pro Fujitsuâs new MOPAC, available now through Chem3Dâs easy graphical interface. Calculate transition state geometries and physical properties using AM1, PM3, MNDO, MINDO/3, and new MINDO/d.
- Gaussian Client Adds Gaussian 98W calculations to Chem3D with a direct client interface (note: Gaussian 98W required).
- Excel Add-on Fully integrated, native MS Excel interface to ChemFinder.
- Download the ChemOffice New Features sheet. (PDF format)
- Download the ChemOffice data sheet. (PDF format)
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