[Chimera-users] how to copy partial charges from a .mol2 file to another

Elaine Meng meng at cgl.ucsf.edu
Wed Feb 29 13:55:29 PST 2012


You're welcome!

You may want to doublecheck that the charges were assigned correctly by saving to another mol2 file, or by showing charge values as labels on the structure with the menu "Actions... Label... other" (label with attribute charge) or commands:

Command: labelopt info charge 
Command: label

Best,
Elaine

On Feb 29, 2012, at 1:48 PM, Thomas Evangelidis wrote:

> Thank you Elaine for the swift reply! It was straight forward, although the atom names were not identical and had to change them manually.
> 
> 
> ~Thomas
> 





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