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CSM Computational Physics Software
Aces2 - Coupled Cluster and Many Body Perturbation Theory methods
AMBER - Assisted Model Building and Energy Refinement is a suite of tools for building, running, and analyzing a variety of molecular dynamics-based calculations.
Gamess - General Atomic and Molecular Electronic Structure System (GAMESS) is a general ab initio quantum chemistry package.
Gaussian 03 - Starting from the basic laws of quantum mechanics, if predicts the energies, molecular structures, and vibrational frequencies of molecular systems
Gaussian 98 - Previous release
Matlab - A powerful computing environment for numeric computation, algorithm development, data visualization, and data analysis.