md.simulation_hooks.BasicTensorboardLogger

class md.simulation_hooks.BasicTensorboardLogger(*args: Any, **kwargs: Any)[source]

Base class for logging scalar information of the system replicas and molecules collected during the simulation to TensorBoard. An individual scalar is created for every molecule, replica and property.

Parameters:

  • log_file (str) – Path to the TensorBoard file.

  • every_n_steps (int) – Frequency with which data is logged to TensorBoard.