| Re: Generating 2D Coords does not work with 3D structures [message #1246 is a reply to message #1244] |
Tue, 09 March 2021 17:20  |
thomas
Messages: 711
Registered: June 2014
|
Senior Member |
|
|
Thank you. There was an issue of not applying a template's 2d-atom-coordinates, if the template consisted of the same atoms that were later automatically discovered as part of a fragment coordinate rule within the coordinate inventor (e.g. a ring or a connecting chain. This is now fixed in the current development version. If you still have issues, please send me a reproducible example. Whether 3D-coordinates exist should not make a difference.
Thomas
|
|
|
|
Search
Help
Members
Register
Login
Home
