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Published 20 hours ago • verified publisher icon mosdef-hub

Site selection

Open mattwthompson opened this issue 6 years ago • 2 comments

A major feature we want to have robust and wide support for is site (atom) selection. What comes to mind at the moment includes:

  • [ ] Site name
  • [ ] Site atomtypes
  • [ ] Sub-topology name
  • [ ] Position
  • [ ] Connections
    • [ ] Number of connections
    • [ ] Properties of connections
  • [ ] Neighbor properties (like within 2 of type C in VMD)

What else do we want to be able to do?

mattwthompson avatar Feb 03 '19 21:02 mattwthompson