Skip to content
New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Jump to bottom

Investigate Aligning Molecules with a minimizer #816

Open
badisa opened this issue Sep 7, 2022 · 0 comments
Open

Investigate Aligning Molecules with a minimizer #816

badisa opened this issue Sep 7, 2022 · 0 comments
Assignees
@badisa
Labels
cr_scipy enhancement New feature or request

Comments

@badisa
Copy link
Collaborator

badisa commented Sep 7, 2022

Refer to comment by @maxentile #813 (comment)

Look at using scipy.optimize.minimize or some other method to reduce the parameterization of alignment.
@badisa badisa added enhancement New feature or request cr_scipy labels Sep 7, 2022
@badisa badisa self-assigned this Sep 7, 2022
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Assignees

@badisa badisa

Labels
cr_scipy enhancement New feature or request
Projects
None yet
Milestone
No milestone
Development

No branches or pull requests
1 participant
@badisa