thanx a lot... On Sat, Jun 9, 2012 at 12:23 AM, Ian Tickle <ianj...@gmail.com> wrote:
> Hi > > You don't need a CIF file for elements or their ions, only for > compounds. Li and Li+1 are already in the list of scattering factors > ($CLIBD/atomsf.lib) as indeed are all the elements with their common > ions. Are you sure you have the atom name in the right columns on the > HETATM record (e.g. Li in 13-14 and LI1+ in 77-80)? > > Cheers > > -- Ian > > On 8 June 2012 19:35, Faisal Tarique <faisaltari...@gmail.com> wrote: > > > > Dear all > > > > i have downloaded lithium coordinates for the density i guess is for > lithium > > but i think while refinement in refmac is not taking lithium into the > > consideration. i want to know how to obtain cif file for lithium and > > incorporate it into the refmac for refinement.. > > > > thanx in advance > > > > l > > > > > > -- > > Regards > > > > Faisal > > School of Life Sciences > > JNU > > > -- Regards Faisal School of Life Sciences JNU
