Pdb2sql

Latest version: v0.5.3

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0.5.2

- Fixed some bugs

0.5.1

- Updated `compute_CapriClass` conditions

0.5.0

- Added atom name selection for lrmsd calculation
- Removed hardcoded chainIDs and added chainID selection in `StructureSimilarity`

0.4.0

- Added `many2sql` to support read multiple PDB files
- Added support for `Path` objects of input PDB files
- Added support for `help(pdb2sql)`
- Updated assignment of chain IDs in `StructureSimilarity`

0.3.0

- Added `align` to superpose a structure to a specific axis or plane
- Added `superpose` to superpose two structures based on selections
- Added `fetch` to download PDB file with given PDB ID
- Updated `interface` object to take `pdb2sql` object as input

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