subject:"\[gmx\-users\] how to add parameters to Topolbuild"

Re: [gmx-users] how to add parameters to Topolbuild

2014-01-02 Thread Bruce D. Ray

On Wednesday, January 1, 2014 at 6:33 PM, Tom dna...@gmail.com wrote: Can someone help us about how to add misssing parameters into Topolbuild? We are using topolbuild to build *top file for a molecular which has amide group. Topolbuld reports missing parameters of bonding, angle and

[gmx-users] how to add parameters to Topolbuild

2014-01-01 Thread Tom

Can someone help us about how to add misssing parameters into Topolbuild? We are using topolbuild to build *top file for a molecular which has amide group. Topolbuld reports missing parameters of bonding, angle and dihedral. missing bond parameters of (C-N); 11 13 ;