Re: [gmx-users] offline version of CgenFF tool?

2017-02-16 Thread Justin Lemkul
On 2/16/17 9:34 AM, Albert wrote: Hello, does anybody have any idea is there any offline tool for generating CgenFF parameters for a ligand? Currently I have to go to cgenff website to generate. It is very inconvenient if we have a vast number of ligand. Contact Prof. Alex MacKerell to

[gmx-users] offline version of CgenFF tool?

2017-02-16 Thread Albert
Hello, does anybody have any idea is there any offline tool for generating CgenFF parameters for a ligand? Currently I have to go to cgenff website to generate. It is very inconvenient if we have a vast number of ligand. Thanks a lot Albert -- Gromacs Users mailing list * Please search