Chemistry and Materials Science

The token  indicates that the package is available at CILEA.

AMBER	AMBER is a suite of programs for molecular dinamics simulations. AMBER. It's available at CILEA Currently is installed on HP Xeon cluster with the version 9
CHARMM	CHARMM (Chemistry at HARvard Macromolecular Mechanics) is a program for macromolecular simulations, including energy minimization, molecular dynamics and Monte Carlo simulations CHARMM It's available at CILEA Exadron AMD Opteron Cluster - Exadron AMD Opteron Cluster for LITBIO users with version 1.1
CPMD	Carr-Parrinello Molecular Dynamics. CPMD. It's available at CILEA Currently is installed on HP Xeon cluster with version 3.11.1
GAMESS	GAMESS is a program for general ab initio quantum chemistry computations. It is maintained by the Gordon research group at Iowa State University. GAMESS It's available at CILEA Currently is installed on HP Xeon cluster with version 2009R1
GROMACS	GROMACS is a versatile package to perform molecular dynamics, primarily designed for biochemical molecules. GROMACS. It's available at CILEA Currently is installed on HP Xeon cluster with version 3.3.3 and 4.0.5
NAMD	NAMD is a parallel molecular dynamics program for UNIX platforms designed for high-performance simulations in structural biology. NAMD It's available at CILEA Currently is installed on the HP servers Exadron Cluster AMD Opteron with version 2.6 and HP Cluster Intel Xeon QuadCore with version 2.6 and Exadron Cluster Intel Xeon with version 2.5.

Edited by: Paolo Ramieri
Modified: 2009-10-26 12:10:30