File coord_extractor.h

↰ Parent directory (extraction)

Header file for coordinate extraction command xyz to extract coordinates from Gaussian outputs.

Definition (extraction/coord_extractor.h)

Includes

• gaussian_extractor.h (File gaussian_extractor.h)

• job_management/job_checker.h (File job_checker.h)

• memory

• string

• unordered_set

• vector

Classes

• Struct ExtractSummary

• Class CoordExtractor