Hi Rob,
On 30/3/2011, at 12:19 p.m., r smith wrote:
> Hi,
>
> Now when using the commands:
>
> mods = loadAmoebaParams em_ac.frcmod
> saveAmoebaParm mol prmtop inpcrd
>
> I get the error:
>
> get typeid of -1
> sleap: data.cpp:424: bool mort::mcmpdata_t::get_iptr(const mort::hashid_t&,
> int, const int*&) const: Assertion `absid >=0 && absid < m_idcounter'
> failed.
> Aborted
>
> Any idea why saveAmoebaParm would cause this problem?
I haven't ever used saveAmoebaParm myself, but if you send me through your files (i.e., mol2, frcmod and anything else needed), I can take a look for you.
Cheers,
Ben
--
For greater security, I support S/MIME encryption.
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
- application/pkcs7-signature attachment: smime.p7s
Received on Wed Mar 30 2011 - 12:30:03 PDT
