Skip to content

Getting ResidueIdentifier without aligned SEQRES #456

@sbliven

Description

@sbliven

Creating a new contact.ResidueIdentifier (not to be confused with ResidueNumber) requires that the Group have a valid alignedResIndex in the corresponding Compound. Is there a reasonable way to handle missing seqres (e.g. if the structure came from a default AtomCache (see #455))?

Would it be better to do contact matching by ResidueNumber instead of seqres index?

Metadata

Metadata

Assignees

Labels

bugBugs and bugfixesminor

Type

No type

Projects

No projects

Milestone

Relationships

None yet

Development

No branches or pull requests

Issue actions