mdpy.io.LogWriter

class mdpy.io.LogWriter(file_path: str, time_step, step: bool = False, sim_time: bool = False, sim_speed: bool = False, potential_energy: bool = False, kinetic_energy: bool = False, total_energy: bool = False, temperature: bool = False, pressure: bool = False, volume: bool = False, density: bool = False, cpu_time: bool = False, rest_time: bool = False, total_step: int = 0, seperator: str = '\t')

__init__(file_path: str, time_step, step: bool = False, sim_time: bool = False, sim_speed: bool = False, potential_energy: bool = False, kinetic_energy: bool = False, total_energy: bool = False, temperature: bool = False, pressure: bool = False, volume: bool = False, density: bool = False, cpu_time: bool = False, rest_time: bool = False, total_step: int = 0, seperator: str = '\t') → None

Methods

__init__(file_path, time_step[, step, ...])
write(ensemble, cur_step)