Ab-initio charges for blocked amino-acids

[Jan Torleif Pedersen <JATP %-% at %-% lundbeck.com>]

Greetings CCLers,
 I am looking for a set of state-of-the-art partial charges for blocked
 amino-acids, derived using ab-initio methods. That is
 N-acetyl-C-aminomethyl-amino-acids. Preferentially for a number of low
 energy conformations.
 If anybody is in possession of such a database for the 20 aminoacids or
 could point me in the direction of some recent publication I would be
 greaful. Also I would be interested in knowing what the best type of
 ab-initio method would give me the best answer in case I should attempt to
 make the calculations myself.
 	Regards
 Dr. Jan Torleif Pedersen
 Dep. Computational Chemistry
 H. Lundbeck A/S
 Ottiliavej 9
 DK-2000 Valby - Copenhagen
 DENMARK
 phone : +45 36 44 24 25 ext 2887
 FAX : +45 36 30 13 85
 email : jatp %-% at %-% lundbeck.com