deepmd.tf.entrypoints.change_bias

DeePMD change bias entrypoint script.

Functions

change_bias(→ None)

Change model out bias according to the input data.

Module Contents

deepmd.tf.entrypoints.change_bias.change_bias(INPUT: str, mode: str = 'change', bias_value: list | None = None, datafile: str | None = None, system: str = '.', numb_batch: int = 0, model_branch: str | None = None, output: str | None = None, log_level: int = 0, **kwargs: Any) → None

Change model out bias according to the input data.

Parameters:

INPUTstr

The input checkpoint file or frozen model file

modestr, optional

The mode for changing energy bias, by default “change”

bias_valueOptional[list], optional

The user defined value for each type, by default None

datafileOptional[str], optional

The path to the datafile, by default None

systemstr, optional

The system dir, by default “.”

numb_batchint, optional

The number of frames for bias changing, by default 0

model_branchOptional[str], optional

Model branch chosen for changing bias if multi-task model, by default None

outputOptional[str], optional

The model after changing bias, by default None

log_levelint, optional

The log level for output, by default 0