cis/trans rotation barrier in peptides?
- From: "Ed E. Moret" <E.E.Moret ( ( at ) )
pharm.uu.nl>
- Organization: Utrecht University
- Subject: cis/trans rotation barrier in peptides?
- Date: Thu, 25 Nov 1999 11:22:01 +0100
Hi CCL
A question for the force field developers; I hope it is not a faq. It
seems
basic though.
I would like to know what the experimental rotation barrier energy of
the amide
bond is in peptides of different composition? So, not just the readily
accessible data on cis/trans isomerisation of prolines.
If this is beyond measurement: has it been computed, taking into account
solvation effects?
With best regards
Ed Moret
--
| Ed E. Moret ( ( ( at ) ) more ( ( at ) ) ) Department of Medicinal Chemistry
| Faculty of Pharmacy Utrecht University The Netherlands
| Tel.: +31 30 2536979(2536958) Fax: +31 30 2536655
| E-mail: E.E.Moret ( ( at ) ) pharm.uu.nl WWW: http://wwwcmc.pharm.uu.nl/moret/