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JCC
2006
78views more  JCC 2006»
13 years 7 months ago
Software news and updates carma: A molecular dynamics analysis program
: A computer program has been developed to aid the analysis of molecular dynamics trajectories. The program is tuned for macromolecular large-scale problems and supports features s...
Nicholas M. Glykos
HPCS
2007
IEEE
14 years 1 months ago
Utilizing Averaged Configuations from Molecular Dynamics Simulation Trajectories
One of the challenges in the large-scale simulations required for many molecular systems (such as those of biological interested) is the recording, monitoring and visualization of...
Peter G. Kusalik, K. Gillis, J. Vatamanu