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OK & thanks for the advice Andy On Thu, 2008-05-22 at 15:20 +0100, Rasmus Fogh wrote: > Dear Andy, > > The data model has specific provision for handling this kind of situation. > Unfortunately this has not been incorporated into the Analysis interface > yet. It may be ready for version 2.0. Meanwhile we would recommend making > a MolSystem with several identical chains, one for each conformation. This > will be a bit more clunky, but it will enable you to store the > information. In theory you could also have several molsystems with a chain > each, but we think a single MolSystem will be more handy. > > The Molecules->Copy Chain Assignments command can help to copy > assignements between chains, and if the situation is not too messy we will > look at converting the result to proper data model objects once Analysis > has caught up. > > I am afraid that is the best we can do at the moment. > > Yours, > > Rasmus > > --------------------------------------------------------------------------- > Dr. Rasmus H. Fogh Email: [log in to unmask] > Dept. of Biochemistry, University of Cambridge, > 80 Tennis Court Road, Cambridge CB2 1GA, UK. FAX (01223)766002 > > On Wed, 21 May 2008, Dr Andy Herbert wrote: > > > Hi, > > > > We have a protein which exists in multiple conformations. We are > > wondering therefore, what is the currently recommended method for > > handling this type of assignment within analysis. > > > > Cheers > > > > Andy > > > > -- > > Dr Andy Herbert > > Department of Chemistry > > University of Edinburgh > > West Mains Road > > Edinburgh > > UK > > EH9 3JJ > > Tel: +44 (0)131 651 3042 or 650 7372 > > Email: [log in to unmask] > > > > > > The University of Edinburgh is a charitable body, registered in > > Scotland, with registration number SC005336. > > > -- Dr Andy Herbert Department of Chemistry University of Edinburgh West Mains Road Edinburgh UK EH9 3JJ Tel: +44 (0)131 651 3042 or 650 7372 Email: [log in to unmask] The University of Edinburgh is a charitable body, registered in Scotland, with registration number SC005336.