Add PLMS sampling and do one 2x size batch per sampling step

README.md

@@ -57,6 +57,7 @@ Quality, sampling speed and diversity are best controlled via the `scale`, `ddim
 As a rule of thumb, higher values of `scale` produce better samples at the cost of a reduced output diversity.   
 Furthermore, increasing `ddim_steps` generally also gives higher quality samples, but returns are diminishing for values > 250.
 Fast sampling (i.e. low values of `ddim_steps`) while retaining good quality can be achieved by using `--ddim_eta 0.0`.  
+Faster sampling (i.e. even lower values of `ddim_steps`) while retaining good quality can be achieved by using `--ddim_eta 0.0` and `--plms` (see [Pseudo Numerical Methods for Diffusion Models on Manifolds](https://arxiv.org/abs/2202.09778)).
 
 #### Beyond 256²
 

ldm/models/diffusion/ddim.py

@@ -166,11 +166,14 @@ def p_sample_ddim(self, x, c, t, index, repeat_noise=False, use_original_steps=F
                       temperature=1., noise_dropout=0., score_corrector=None, corrector_kwargs=None,
                       unconditional_guidance_scale=1., unconditional_conditioning=None):
         b, *_, device = *x.shape, x.device
-        e_t = self.model.apply_model(x, t, c)
 
-        if unconditional_guidance_scale != 1.:
-            assert unconditional_conditioning is not None
-            e_t_uncond =  self.model.apply_model(x, t, unconditional_conditioning)
+        if unconditional_conditioning is None or unconditional_guidance_scale == 1.:
+            e_t = self.model.apply_model(x, t, c)
+        else:
+            x_in = torch.cat([x] * 2)
+            t_in = torch.cat([t] * 2)
+            c_in = torch.cat([unconditional_conditioning, c])
+            e_t_uncond, e_t = self.model.apply_model(x_in, t_in, c_in).chunk(2)
             e_t = e_t_uncond + unconditional_guidance_scale * (e_t - e_t_uncond)
 
         if score_corrector is not None:

ldm/models/diffusion/plms.py

@@ -0,0 +1,236 @@
+"""SAMPLING ONLY."""
+
+import torch
+import numpy as np
+from tqdm import tqdm
+from functools import partial
+
+from ldm.modules.diffusionmodules.util import make_ddim_sampling_parameters, make_ddim_timesteps, noise_like
+
+
+class PLMSSampler(object):
+    def __init__(self, model, schedule="linear", **kwargs):
+        super().__init__()
+        self.model = model
+        self.ddpm_num_timesteps = model.num_timesteps
+        self.schedule = schedule
+
+    def register_buffer(self, name, attr):
+        if type(attr) == torch.Tensor:
+            if attr.device != torch.device("cuda"):
+                attr = attr.to(torch.device("cuda"))
+        setattr(self, name, attr)
+
+    def make_schedule(self, ddim_num_steps, ddim_discretize="uniform", ddim_eta=0., verbose=True):
+        if ddim_eta != 0:
+            raise ValueError('ddim_eta must be 0 for PLMS')
+        self.ddim_timesteps = make_ddim_timesteps(ddim_discr_method=ddim_discretize, num_ddim_timesteps=ddim_num_steps,
+                                                  num_ddpm_timesteps=self.ddpm_num_timesteps,verbose=verbose)
+        alphas_cumprod = self.model.alphas_cumprod
+        assert alphas_cumprod.shape[0] == self.ddpm_num_timesteps, 'alphas have to be defined for each timestep'
+        to_torch = lambda x: x.clone().detach().to(torch.float32).to(self.model.device)
+
+        self.register_buffer('betas', to_torch(self.model.betas))
+        self.register_buffer('alphas_cumprod', to_torch(alphas_cumprod))
+        self.register_buffer('alphas_cumprod_prev', to_torch(self.model.alphas_cumprod_prev))
+
+        # calculations for diffusion q(x_t | x_{t-1}) and others
+        self.register_buffer('sqrt_alphas_cumprod', to_torch(np.sqrt(alphas_cumprod.cpu())))
+        self.register_buffer('sqrt_one_minus_alphas_cumprod', to_torch(np.sqrt(1. - alphas_cumprod.cpu())))
+        self.register_buffer('log_one_minus_alphas_cumprod', to_torch(np.log(1. - alphas_cumprod.cpu())))
+        self.register_buffer('sqrt_recip_alphas_cumprod', to_torch(np.sqrt(1. / alphas_cumprod.cpu())))
+        self.register_buffer('sqrt_recipm1_alphas_cumprod', to_torch(np.sqrt(1. / alphas_cumprod.cpu() - 1)))
+
+        # ddim sampling parameters
+        ddim_sigmas, ddim_alphas, ddim_alphas_prev = make_ddim_sampling_parameters(alphacums=alphas_cumprod.cpu(),
+                                                                                   ddim_timesteps=self.ddim_timesteps,
+                                                                                   eta=ddim_eta,verbose=verbose)
+        self.register_buffer('ddim_sigmas', ddim_sigmas)
+        self.register_buffer('ddim_alphas', ddim_alphas)
+        self.register_buffer('ddim_alphas_prev', ddim_alphas_prev)
+        self.register_buffer('ddim_sqrt_one_minus_alphas', np.sqrt(1. - ddim_alphas))
+        sigmas_for_original_sampling_steps = ddim_eta * torch.sqrt(
+            (1 - self.alphas_cumprod_prev) / (1 - self.alphas_cumprod) * (
+                        1 - self.alphas_cumprod / self.alphas_cumprod_prev))
+        self.register_buffer('ddim_sigmas_for_original_num_steps', sigmas_for_original_sampling_steps)
+
+    @torch.no_grad()
+    def sample(self,
+               S,
+               batch_size,
+               shape,
+               conditioning=None,
+               callback=None,
+               normals_sequence=None,
+               img_callback=None,
+               quantize_x0=False,
+               eta=0.,
+               mask=None,
+               x0=None,
+               temperature=1.,
+               noise_dropout=0.,
+               score_corrector=None,
+               corrector_kwargs=None,
+               verbose=True,
+               x_T=None,
+               log_every_t=100,
+               unconditional_guidance_scale=1.,
+               unconditional_conditioning=None,
+               # this has to come in the same format as the conditioning, # e.g. as encoded tokens, ...
+               **kwargs
+               ):
+        if conditioning is not None:
+            if isinstance(conditioning, dict):
+                cbs = conditioning[list(conditioning.keys())[0]].shape[0]
+                if cbs != batch_size:
+                    print(f"Warning: Got {cbs} conditionings but batch-size is {batch_size}")
+            else:
+                if conditioning.shape[0] != batch_size:
+                    print(f"Warning: Got {conditioning.shape[0]} conditionings but batch-size is {batch_size}")
+
+        self.make_schedule(ddim_num_steps=S, ddim_eta=eta, verbose=verbose)
+        # sampling
+        C, H, W = shape
+        size = (batch_size, C, H, W)
+        print(f'Data shape for PLMS sampling is {size}')
+
+        samples, intermediates = self.plms_sampling(conditioning, size,
+                                                    callback=callback,
+                                                    img_callback=img_callback,
+                                                    quantize_denoised=quantize_x0,
+                                                    mask=mask, x0=x0,
+                                                    ddim_use_original_steps=False,
+                                                    noise_dropout=noise_dropout,
+                                                    temperature=temperature,
+                                                    score_corrector=score_corrector,
+                                                    corrector_kwargs=corrector_kwargs,
+                                                    x_T=x_T,
+                                                    log_every_t=log_every_t,
+                                                    unconditional_guidance_scale=unconditional_guidance_scale,
+                                                    unconditional_conditioning=unconditional_conditioning,
+                                                    )
+        return samples, intermediates
+
+    @torch.no_grad()
+    def plms_sampling(self, cond, shape,
+                      x_T=None, ddim_use_original_steps=False,
+                      callback=None, timesteps=None, quantize_denoised=False,
+                      mask=None, x0=None, img_callback=None, log_every_t=100,
+                      temperature=1., noise_dropout=0., score_corrector=None, corrector_kwargs=None,
+                      unconditional_guidance_scale=1., unconditional_conditioning=None,):
+        device = self.model.betas.device
+        b = shape[0]
+        if x_T is None:
+            img = torch.randn(shape, device=device)
+        else:
+            img = x_T
+
+        if timesteps is None:
+            timesteps = self.ddpm_num_timesteps if ddim_use_original_steps else self.ddim_timesteps
+        elif timesteps is not None and not ddim_use_original_steps:
+            subset_end = int(min(timesteps / self.ddim_timesteps.shape[0], 1) * self.ddim_timesteps.shape[0]) - 1
+            timesteps = self.ddim_timesteps[:subset_end]
+
+        intermediates = {'x_inter': [img], 'pred_x0': [img]}
+        time_range = list(reversed(range(0,timesteps))) if ddim_use_original_steps else np.flip(timesteps)
+        total_steps = timesteps if ddim_use_original_steps else timesteps.shape[0]
+        print(f"Running PLMS Sampling with {total_steps} timesteps")
+
+        iterator = tqdm(time_range, desc='PLMS Sampler', total=total_steps)
+        old_eps = []
+
+        for i, step in enumerate(iterator):
+            index = total_steps - i - 1
+            ts = torch.full((b,), step, device=device, dtype=torch.long)
+            ts_next = torch.full((b,), time_range[min(i + 1, len(time_range) - 1)], device=device, dtype=torch.long)
+
+            if mask is not None:
+                assert x0 is not None
+                img_orig = self.model.q_sample(x0, ts)  # TODO: deterministic forward pass?
+                img = img_orig * mask + (1. - mask) * img
+
+            outs = self.p_sample_plms(img, cond, ts, index=index, use_original_steps=ddim_use_original_steps,
+                                      quantize_denoised=quantize_denoised, temperature=temperature,
+                                      noise_dropout=noise_dropout, score_corrector=score_corrector,
+                                      corrector_kwargs=corrector_kwargs,
+                                      unconditional_guidance_scale=unconditional_guidance_scale,
+                                      unconditional_conditioning=unconditional_conditioning,
+                                      old_eps=old_eps, t_next=ts_next)
+            img, pred_x0, e_t = outs
+            old_eps.append(e_t)
+            if len(old_eps) >= 4:
+                old_eps.pop(0)
+            if callback: callback(i)
+            if img_callback: img_callback(pred_x0, i)
+
+            if index % log_every_t == 0 or index == total_steps - 1:
+                intermediates['x_inter'].append(img)
+                intermediates['pred_x0'].append(pred_x0)
+
+        return img, intermediates
+
+    @torch.no_grad()
+    def p_sample_plms(self, x, c, t, index, repeat_noise=False, use_original_steps=False, quantize_denoised=False,
+                      temperature=1., noise_dropout=0., score_corrector=None, corrector_kwargs=None,
+                      unconditional_guidance_scale=1., unconditional_conditioning=None, old_eps=None, t_next=None):
+        b, *_, device = *x.shape, x.device
+
+        def get_model_output(x, t):
+            if unconditional_conditioning is None or unconditional_guidance_scale == 1.:
+                e_t = self.model.apply_model(x, t, c)
+            else:
+                x_in = torch.cat([x] * 2)
+                t_in = torch.cat([t] * 2)
+                c_in = torch.cat([unconditional_conditioning, c])
+                e_t_uncond, e_t = self.model.apply_model(x_in, t_in, c_in).chunk(2)
+                e_t = e_t_uncond + unconditional_guidance_scale * (e_t - e_t_uncond)
+
+            if score_corrector is not None:
+                assert self.model.parameterization == "eps"
+                e_t = score_corrector.modify_score(self.model, e_t, x, t, c, **corrector_kwargs)
+
+            return e_t
+
+        alphas = self.model.alphas_cumprod if use_original_steps else self.ddim_alphas
+        alphas_prev = self.model.alphas_cumprod_prev if use_original_steps else self.ddim_alphas_prev
+        sqrt_one_minus_alphas = self.model.sqrt_one_minus_alphas_cumprod if use_original_steps else self.ddim_sqrt_one_minus_alphas
+        sigmas = self.model.ddim_sigmas_for_original_num_steps if use_original_steps else self.ddim_sigmas
+
+        def get_x_prev_and_pred_x0(e_t, index):
+            # select parameters corresponding to the currently considered timestep
+            a_t = torch.full((b, 1, 1, 1), alphas[index], device=device)
+            a_prev = torch.full((b, 1, 1, 1), alphas_prev[index], device=device)
+            sigma_t = torch.full((b, 1, 1, 1), sigmas[index], device=device)
+            sqrt_one_minus_at = torch.full((b, 1, 1, 1), sqrt_one_minus_alphas[index],device=device)
+
+            # current prediction for x_0
+            pred_x0 = (x - sqrt_one_minus_at * e_t) / a_t.sqrt()
+            if quantize_denoised:
+                pred_x0, _, *_ = self.model.first_stage_model.quantize(pred_x0)
+            # direction pointing to x_t
+            dir_xt = (1. - a_prev - sigma_t**2).sqrt() * e_t
+            noise = sigma_t * noise_like(x.shape, device, repeat_noise) * temperature
+            if noise_dropout > 0.:
+                noise = torch.nn.functional.dropout(noise, p=noise_dropout)
+            x_prev = a_prev.sqrt() * pred_x0 + dir_xt + noise
+            return x_prev, pred_x0
+
+        e_t = get_model_output(x, t)
+        if len(old_eps) == 0:
+            # Pseudo Improved Euler (2nd order)
+            x_prev, pred_x0 = get_x_prev_and_pred_x0(e_t, index)
+            e_t_next = get_model_output(x_prev, t_next)
+            e_t_prime = (e_t + e_t_next) / 2
+        elif len(old_eps) == 1:
+            # 2nd order Pseudo Linear Multistep (Adams-Bashforth)
+            e_t_prime = (3 * e_t - old_eps[-1]) / 2
+        elif len(old_eps) == 2:
+            # 3nd order Pseudo Linear Multistep (Adams-Bashforth)
+            e_t_prime = (23 * e_t - 16 * old_eps[-1] + 5 * old_eps[-2]) / 12
+        elif len(old_eps) >= 3:
+            # 4nd order Pseudo Linear Multistep (Adams-Bashforth)
+            e_t_prime = (55 * e_t - 59 * old_eps[-1] + 37 * old_eps[-2] - 9 * old_eps[-3]) / 24
+
+        x_prev, pred_x0 = get_x_prev_and_pred_x0(e_t_prime, index)
+
+        return x_prev, pred_x0, e_t

scripts/txt2img.py

@@ -9,6 +9,7 @@
 
 from ldm.util import instantiate_from_config
 from ldm.models.diffusion.ddim import DDIMSampler
+from ldm.models.diffusion.plms import PLMSSampler
 
 
 def load_model_from_config(config, ckpt, verbose=False):
@@ -54,6 +55,12 @@ def load_model_from_config(config, ckpt, verbose=False):
         help="number of ddim sampling steps",
     )
 
+    parser.add_argument(
+        "--plms",
+        action='store_true',
+        help="use plms sampling",
+    )
+
     parser.add_argument(
         "--ddim_eta",
         type=float,
@@ -102,7 +109,11 @@ def load_model_from_config(config, ckpt, verbose=False):
 
     device = torch.device("cuda") if torch.cuda.is_available() else torch.device("cpu")
     model = model.to(device)
-    sampler = DDIMSampler(model)
+
+    if opt.plms:
+        sampler = PLMSSampler(model)
+    else:
+        sampler = DDIMSampler(model)
 
     os.makedirs(opt.outdir, exist_ok=True)
     outpath = opt.outdir