scripts.data.preprocessing.packageTensors

Functions that generate features from dTERMen files .dat and .red.pdb

Functions

dumpCoordsTensors(in_path[, out_path, save])

Create a feature file based only on the coordinate information, placing dummy arrays for all TERM based items.

dumpTrainingTensors(in_path[, out_path, ...])

Generate features from dTERMen .dat and .red.pdb, and dump the output into a file if requested.