[gmx-users] how to obtain NOEs from MD trajectory ?

Jose Borreguero borreguero at gmail.com
Tue Nov 22 15:22:12 CET 2011


Dear Gromacs users,

Is there any algorithm/procedure to calculate NOEs from an MD trajectory?
I'd greatly appreciate any references where the algorithm is described.

Best regards,
Jose M. Borreguero
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