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Computational Chemistry Software Updates

Computational Chemistry Software Update

 

May 30, 2006

Gromacs Version 3.3.1 has been installed on Mercury.

 

May 29, 2006

NAMD 2.6b1 has been installed on Mercury.

 

April 13, 2006

Gaussian 03 Version D.01 has been installed on Mercury.

 

 

April 11, 2006

CPMD 3.11.1 has been installed on Cobalt.

 

 

March 30, 2006

Gaussian 03 Version D.01 on Copper had been enabled with NBO 5.0g.