[AMBER] unable to read MM charges

From: Vishal Maingi <maingipaws.yahoo.co.in>
Date: Mon, 6 Jul 2009 10:32:29 +0100


dear AMBER users,

I used my optimised (dft method in gaussian) residues to make macromolecule in AMBER. and corected the entangles in it manually. then I tried to optimise it in gaussian using molecular mechanics using amber ff in gaussian but error "unable to read MM charges" was displayed in gaussian when input (*.com) file was opened. also in output file (*.log) error is there indicating MM microiterations.

what can be the solution to it and what I may be missing , earlier I used the same residues and made macromolecule though containing less residues than this time. but no such errors were there.

thanks

VM


      ICC World Twenty20 England &#39;09 exclusively on YAHOO! CRICKET http://cricket.yahoo.com


_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Mon Jul 06 2009 - 17:37:29 PDT
Custom Search