feat: allow use of functional API by sanitizing build input shapes (#332

)

bayesflow/networks/deep_set/deep_set.py

@@ -5,6 +5,7 @@
 
 from bayesflow.types import Tensor
 from bayesflow.utils import filter_kwargs
+from bayesflow.utils.decorators import sanitize_input_shape
 
 from .equivariant_module import EquivariantModule
 from .invariant_module import InvariantModule
@@ -78,6 +79,7 @@ def __init__(
         self.output_projector = keras.layers.Dense(summary_dim, activation="linear")
         self.summary_dim = summary_dim
 
+    @sanitize_input_shape
     def build(self, input_shape):
         super().build(input_shape)
         self.call(keras.ops.zeros(input_shape))

bayesflow/networks/deep_set/equivariant_module.py

@@ -5,6 +5,7 @@
 from keras.saving import register_keras_serializable as serializable
 
 from bayesflow.types import Tensor
+from bayesflow.utils.decorators import sanitize_input_shape
 from .invariant_module import InvariantModule
 
 
@@ -66,6 +67,7 @@ def __init__(
 
         self.layer_norm = layers.LayerNormalization() if layer_norm else None
 
+    @sanitize_input_shape
     def build(self, input_shape):
         self.call(keras.ops.zeros(input_shape))
 

bayesflow/networks/deep_set/invariant_module.py

@@ -6,6 +6,7 @@
 
 from bayesflow.types import Tensor
 from bayesflow.utils import find_pooling
+from bayesflow.utils.decorators import sanitize_input_shape
 
 
 @serializable(package="bayesflow.networks")
@@ -76,6 +77,7 @@ def __init__(
 
         self.pooling_layer = find_pooling(pooling, **pooling_kwargs)
 
+    @sanitize_input_shape
     def build(self, input_shape):
         self.call(keras.ops.zeros(input_shape))
 

bayesflow/networks/lstnet/lstnet.py

@@ -2,6 +2,7 @@
 from keras.saving import register_keras_serializable as serializable
 
 from bayesflow.types import Tensor
+from bayesflow.utils.decorators import sanitize_input_shape
 from .skip_recurrent import SkipRecurrentNet
 from ..summary_network import SummaryNetwork
 
@@ -78,6 +79,7 @@ def call(self, x: Tensor, training: bool = False, **kwargs) -> Tensor:
         x = self.output_projector(x)
         return x
 
+    @sanitize_input_shape
     def build(self, input_shape):
         super().build(input_shape)
         self.call(keras.ops.zeros(input_shape))

bayesflow/networks/lstnet/skip_recurrent.py

@@ -3,6 +3,7 @@
 
 from bayesflow.types import Tensor
 from bayesflow.utils import keras_kwargs, find_recurrent_net
+from bayesflow.utils.decorators import sanitize_input_shape
 
 
 @serializable(package="bayesflow.networks")
@@ -58,5 +59,6 @@ def call(self, time_series: Tensor, training: bool = False, **kwargs) -> Tensor:
         skip_summary = self.skip_recurrent(self.skip_conv(time_series), training=training)
         return keras.ops.concatenate((direct_summary, skip_summary), axis=-1)
 
+    @sanitize_input_shape
     def build(self, input_shape):
         self.call(keras.ops.zeros(input_shape))

bayesflow/networks/summary_network.py

@@ -3,13 +3,15 @@
 from bayesflow.metrics.functional import maximum_mean_discrepancy
 from bayesflow.types import Tensor
 from bayesflow.utils import find_distribution, keras_kwargs
+from bayesflow.utils.decorators import sanitize_input_shape
 
 
 class SummaryNetwork(keras.Layer):
     def __init__(self, base_distribution: str = None, **kwargs):
         super().__init__(**keras_kwargs(kwargs))
         self.base_distribution = find_distribution(base_distribution)
 
+    @sanitize_input_shape
     def build(self, input_shape):
         if self.base_distribution is not None:
             output_shape = keras.ops.shape(self.call(keras.ops.zeros(input_shape)))

bayesflow/utils/decorators.py

@@ -2,6 +2,7 @@
 from functools import wraps
 import inspect
 from typing import overload, TypeVar
+from bayesflow.types import Shape
 
 Fn = TypeVar("Fn", bound=Callable[..., any])
 
@@ -110,3 +111,20 @@ def callback(x):
     fn = alias("batch_shape", "batch_size")(fn)
 
     return fn
+
+
+def sanitize_input_shape(fn: Callable):
+    """Decorator to replace the first dimension in input_shape with a dummy batch size if it is None"""
+
+    # The Keras functional API passes input_shape = (None, second_dim, third_dim, ...), which
+    # causes problems when constructions like self.call(keras.ops.zeros(input_shape)) are used
+    # in build. To alleviate those problems, this decorator replaces None with an arbitrary batch size.
+    def callback(input_shape: Shape) -> Shape:
+        if input_shape[0] is None:
+            input_shape = list(input_shape)
+            input_shape[0] = 32
+            return tuple(input_shape)
+        return input_shape
+
+    fn = argument_callback("input_shape", callback)(fn)
+    return fn