File size: 5,451 Bytes
eae86f2
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
"""Shared configuration, analytic sampling, and reference-only evaluation."""
import hashlib
import json
from pathlib import Path

import numpy as np
import torch
import yaml


LOSS_NAMES = ('u_in', 'v_in', 'p_out', 'u_noslip', 'v_noslip', 'u_res', 'v_res', 'p_res')


def load_config(path):
    path = Path(path).resolve()
    cfg = yaml.safe_load(path.read_text())
    root = (path.parent / cfg['paths']['output_dir']).resolve()
    reference = Path(cfg['evaluation']['reference_vtu'])
    if not reference.is_absolute():
        cfg['evaluation']['reference_vtu'] = str(root / reference)
    cfg['_root'] = str(root)
    return cfg, root


def atomic_json(path, obj):
    path = Path(path)
    path.parent.mkdir(parents=True, exist_ok=True)
    tmp = path.with_name(path.name + '.tmp')
    tmp.write_text(json.dumps(obj, indent=2, ensure_ascii=False, allow_nan=False))
    tmp.replace(path)


def atomic_save(path, obj):
    path = Path(path)
    path.parent.mkdir(parents=True, exist_ok=True)
    tmp = path.with_name(path.name + '.tmp')
    torch.save(obj, tmp)
    tmp.replace(path)


def sample_interior(cfg, device, generator=None, count=None):
    d = cfg['domain']
    n = cfg['training']['batch_size'] if count is None else count
    z = torch.rand(n, 2, device=device, generator=generator)
    low = z.new_tensor([d['x_min'], d['y_min']])
    span = z.new_tensor([d['x_max'] - d['x_min'], d['y_max'] - d['y_min']])
    return low + span * z


def analytic_boundaries(cfg, device):
    d, b = cfg['domain'], cfg['boundary']
    yl = torch.linspace(d['y_min'], d['y_max'], b['left_points'], device=device)
    left = torch.stack((torch.full_like(yl, d['x_min']), yl), -1)
    # Group the whole left boundary in the two left-boundary loss terms,
    # as in the author's discretization: its lower half has zero velocity.
    inlet = left
    yo = torch.linspace(d['y_min'], d['y_max'], b['outlet_points'], device=device)
    outlet = torch.stack((torch.full_like(yo, d['x_max']), yo), -1)
    x = torch.linspace(d['x_min'], d['x_max'], b['points_per_horizontal_wall'], device=device)
    walls = torch.cat((torch.stack((x, torch.full_like(x, d['y_min'])), -1),
                       torch.stack((x, torch.full_like(x, d['y_max'])), -1)))
    u_in = torch.where(yl >= 0, 24.0 * yl * (0.5 - yl), torch.zeros_like(yl))
    return inlet, outlet, walls, u_in


def boundary_losses(model, boundary):
    inlet, outlet, walls, target = boundary
    sizes = [len(inlet), len(outlet), len(walls)]
    pi, po, pw = model(torch.cat((inlet, outlet, walls))).split(sizes)
    return torch.stack(((pi[:, 0] - target).square().mean(), pi[:, 1].square().mean(),
                        po[:, 2].square().mean(), pw[:, 0].square().mean(), pw[:, 1].square().mean()))


def read_reference(path, expected_points=None):
    # VTU is a genuine SU2 field. Never called by sample_interior/analytic_boundaries.
    from vtk import vtkXMLUnstructuredGridReader
    from vtk.util.numpy_support import vtk_to_numpy
    p = Path(path)
    reader = vtkXMLUnstructuredGridReader()
    reader.SetFileName(str(p))
    reader.Update()
    mesh = reader.GetOutput()
    n = mesh.GetNumberOfPoints()
    if expected_points is not None and n != expected_points:
        raise ValueError(f'Expected {expected_points} reference points, got {n}')
    vel = mesh.GetPointData().GetArray('Velocity')
    pressure = mesh.GetPointData().GetArray('Pressure')
    if vel is None or pressure is None:
        raise ValueError('VTU must contain Velocity and Pressure PointData')
    xy = vtk_to_numpy(mesh.GetPoints().GetData())[:, :2].copy()
    velocity = vtk_to_numpy(vel).copy()
    uvp = np.column_stack((velocity[:, 0], velocity[:, 1], vtk_to_numpy(pressure)))
    if not np.isfinite(xy).all() or not np.isfinite(uvp).all():
        raise ValueError('Nonfinite reference data')
    metadata = {'source': str(p.resolve()), 'sha256': hashlib.sha256(p.read_bytes()).hexdigest(),
                'points': n, 'target_field': 'Velocity', 'target_component': 0,
                'training_labels_used': False, 'bounds': [xy.min(0).tolist(), xy.max(0).tolist()]}
    return xy, uvp, metadata, mesh


@torch.no_grad()
def predict(model, xy, device, batch_size=4096):
    pred = []
    for start in range(0, len(xy), batch_size):
        x = torch.as_tensor(xy[start:start + batch_size], dtype=torch.float32, device=device)
        pred.append(model(x).cpu().numpy())
    return np.concatenate(pred)


def errors(pred, ref):
    # Accumulate in float64, unweighted over every original reference mesh point.
    delta = pred.astype(np.float64) - ref.astype(np.float64)
    return {'relative_l2_u': float(np.linalg.norm(delta[:, 0]) / np.linalg.norm(ref[:, 0].astype(np.float64))),
            'relative_l2_v': float(np.linalg.norm(delta[:, 1]) / np.linalg.norm(ref[:, 1].astype(np.float64)))}


def build_model(cfg, device):
    from model.PseudoTimePINN import PseudoTimePINN
    d = cfg['domain']
    return PseudoTimePINN(**cfg['model'], length=d['x_max'] - d['x_min'],
                          height=d['y_max'] - d['y_min']).to(device)


def require_compute_node(cfg):
    import os
    if cfg['training']['require_slurm'] and not os.environ.get('SLURM_JOB_ID'):
        raise RuntimeError('DCU execution requires a Slurm allocation; login-node training is forbidden')
    if not torch.cuda.is_available():
        raise RuntimeError('Allocated DCU is not accessible through torch.cuda')