| 9:55:35 PM PDT - Sun, Jul 26th 2015 |
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Need to understand if NWChem would be useful to evaluate comparative transition state energies of metal coordinated (Co, Ni, Cu and Zn) imidazole H-D exchange?
Second question: Would it be unreasonable (more than a week to complete a single run) to process on a single core-2 duo Intel based platform?
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