openmolecules.org Forum: Functionality

Search
Help
Members
Register
Login
Home

Home » DataWarrior » Functionality » Conformers and xyz (How to get more of them and how to export)

Show: Today's Messages :: Polls :: Message Navigator

Conformers and xyz [message #661]

Thu, 10 October 2019 22:15

lutek14
Messages: 3
Registered: October 2019

Junior Member

Hello!
DataWarrior looks pretty awesome, however I'd like to know two things:
a) is it possible to generate chosen number of conformers (e.g. 10 instead of 2)?
b) is it possible to export CONFORMERS (as .xyz or .mol format), so they can be used in other programs?
Thank You

Report message to a moderator

[Message index]

		Conformers and xyz By: lutek14 on Thu, 10 October 2019 22:15
		Re: Conformers and xyz By: thomas on Fri, 11 October 2019 19:06

Previous Topic:	Aligning molecules to a common substructure
Next Topic:	Set 3D View Alignment

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Fri Sep 04 15:36:58 CEST 2026

Total time taken to generate the page: 0.00651 seconds