Hi Tim,
Unfortunately we no longer have moleman installed, so I couldn't easily use
it. I found a few other options, but none of them transferred the ANISOU
records.
The solution was to use MAXIT (a pdb format checker) to convert to a cif
file and then back to pdb while retaining the ANISOU records
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA1
Hello,
you mention having used moleman before - what's wrong with it?
Tim
On 01/16/2012 05:09 PM, Elizabeth Sprague wrote:
> Hi All,
> Extensive rebuilding of a structure in coot resulted in changes in the order
> of the atoms within each residue.
Hi All,
Extensive rebuilding of a structure in coot resulted in changes in the order of
the atoms within each residue. I seem to recall experiencing this reordering
before and using MOLEMAN (correct nomenclature) to revert back to "traditional"
ordering of atoms.
While most programs do not seem
