Wavefunction Announces MacSpartan Plus (Version 2.0)

August 1, 2000 Wavefunction has just released MacSpartan Plus 2.0. Version 2.0 incorporates many new computational tools, graphics capabilities, and export options not found in the original version.

PC Spartan Plus V2 Software PackageThe affordable, easy to use Mac Spartan Plus Version 2.0 allows any chemist to:

Build organic, organometallic and inorganic molecules and polypeptides. Obtain transition states from an extensive reaction database.

Calculate with Molecular mechanics (SYBYL, MMFF), Semi-empirical (AM1, PM3 including transition metals, MNDO, MNDO/d, AM1-SM5.4), Ab Initio (Hartree-Fock).

Display multiple model styles. Calculate properties, volumes and surface areas, dipole moments, and atomic charges. Present 3D isosurface and 2D slice displays of electron densities, spin densities, electrostatic potentials, and molecular orbitals. Map properties onto an isosurface.

Perform minimum conformer search, calculate erergies, heats of formation or strain energies, evaluate normal-mode vibrational frequencies. Export as JPEG, BMP, or Spartan exchange formats.

1. MMFF Mechanics
2. MNDO, MNDO/d, AM1-SM5.4 Semi Empirical
3. 6-31G*, 6-31G**, 6-31+G*, 6-311G*, 6-311+G** basis sets
4. Display 3D isosurfaces and 2D slices
5. Search for best conformer
6. Export JPEG, BMP, or Spartan exchange files

General Information:

Wavefunction produces molecular modeling software and publications for both industry and academia. Their applications are used by chemists in research and education at thousands of sites around the world.

Wavefunction was founded in 1991 by Dr. Hehre to promote the development and utilization of computational chemistry and molecular modeling in the mainstream chemistry community.

For pricing and additional information, contact:
Wavefunction, Inc.
(949) 955-2120