Re: CCL:Standard Bond Lengths?
- From: dengolovanov <dengolovanov[at]pisem.net>
- Subject: Re: CCL:Standard Bond Lengths?
- Date: Thu, 31 Jul 2003 05:59:46 +0400
Peter, the most reasonable way to solve your problem is to order (or
find some one of your friends...) Cambridge Structure Database. You'll
find there anythind you want and you may also make statistical
analysis halp with it.
PO> Hello CCLers,
PO> I'm looking for standard bond lengths between various atoms in organic
PO> molecules. I'm using these bond lengths in a molecular mechanics force
field
PO> (GRID) for flexible ligand docking. I require bond lengths between each
atom
PO> type i.e. an aromatic carbon and an sp3 NH group with a lone pair etc etc
PO> Does anybody know of any resources avialable ? Like a database or
websites?
PO> Any help on this matter would be greatly appreciated
PO> Cheers
PO> Peter
--
Best regards,
dengolovanov mailto:dengolovanov[at]pisem.net