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AMBER Archive (2006)Subject: AMBER: Bond Force Conctants in Amber Force Fields
From: åÇÏÒÏ× ä.á. (egorov_at_newhospital.ru)
Dear Amber list members,
How are force bond force constants k natural, i. e. are they exactly equal spectroscopic harmonic force constants for parametrized compounds. And if they are not, then could anybody tell me where can I obtain these spectroscopic quantities for biological substanses - may be, somewhere is compiled source of these data?
D. Egorov, USMA, Yekaterinburg, Russia.
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