[Chimera-users] addgrp command

Elaine Meng meng at cgl.ucsf.edu
Wed Aug 26 13:28:51 PDT 2015


Hi Xiaobo,
Sorry no, there is no command to add a chemical group in Chimera.
Best,
Elaine
-----
Elaine C. Meng, Ph.D.                       
UCSF Computer Graphics Lab (Chimera team) and Babbitt Lab
Department of Pharmaceutical Chemistry
University of California, San Francisco

On Aug 26, 2015, at 10:53 AM, UCSF-xiaobowan <Xiaobo.Wan at ucsf.edu> wrote:

> Hi all,
> I am Xiaobo Wan, a postdoc at UCSF. I would like to learn how to add chemical groups (such as methyl) or change chemical atoms (Fluorine to Nitrogen) using the command in Chimera because I have thousands of compounds to do the same modification. I know the Build Structure in the Graphic interface can do this. I am not sure whether the addgrp command was supported by chimera now.
> Best,
> Xiaobo




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