Function pdbtbx::save_pdb

pub fn save_pdb(
    pdb: PDB, 
    filename: &str, 
    level: StrictnessLevel
) -> Result<(), Vec<PDBError>>

Save the given PDB struct to the given file. It validates the PDB. It fails if the validation fails with the given level. If validation gives rise to problems use the save_raw function.

Known Problems

Saving SEQRES lines is experimental, as there are many nitpicky things to consider when generating SEQRES records, which are not all implemented (yet).