MHCXGraph.pydssp.pydssp¶

MHCXGraph.pydssp.pydssp.assign(coord: ndarray, donor_mask: ndarray = None, out_type: Literal['onehot', 'index', 'c3'] = 'c3') → ndarray[source]¶

MHCXGraph.pydssp.pydssp.get_hbond_map(coord: ndarray, donor_mask: ndarray = None, cutoff: float = -0.5, margin: float = 1.0, return_e: bool = False) → ndarray[source]¶

Functions¶

`assign`(coord[, donor_mask, out_type])
`get_hbond_map`(coord[, donor_mask, cutoff, ...])