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An open sourcecode for the analysis of electronic excited states:
Natural Transition Orbitals;
Detachment and Attachment Density Matrices;
Quantum Chemical Charge-Transfer Descriptors.
The code is intended to postprocess Gaussian 03 and 09 outputs.
Important Note: A new release with better compilation option has been released on November the 9th 2015.
ea-fold is a platform to perform protein folding simulations by means of evolutionary algorithms. The program implements a parallelized distributed evolutionary algorithms and a flexible force field.