Exemple #1
0
    def test_StopGrad(self):
        print('==========StopGrad tests==========')
        from astroNN.nn.layers import StopGrad

        # Data preparation
        random_xdata = np.random.normal(0, 1, (100, 7514))
        random_ydata = np.random.normal(0, 1, (100, 25))

        input = Input(shape=[7514])
        output = Dense(25)(input)
        stopped_output = StopGrad(name='stopgrad', always_on=True)(output)
        model = Model(inputs=input, outputs=output)
        model_stopped = Model(inputs=input, outputs=stopped_output)
        model.compile(optimizer='adam', loss='mse')

        model_stopped.compile(optimizer='adam', loss='mse')
        # assert error because of no gradient via this layer
        self.assertRaises(ValueError,
                          model_stopped.fit,
                          random_xdata,
                          random_ydata,
                          batch_size=128,
                          epochs=1)
        # keras.backend.get_session().run(keras.backend.gradients(output, input), feed_dict={input: random_xdata, keras.backend.learning_phase(): 0})

        x = model.predict(random_xdata)
        y = model_stopped.predict(random_xdata)
        npt.assert_almost_equal(
            x, y)  # make sure StopGrad does not change any result

        # # =================test weight equals================= #
        input2 = Input(shape=[7514])
        dense1 = Dense(100, name='normaldense')(input2)
        dense2 = Dense(25, name='wanted_dense')(input2)
        dense2_stopped = StopGrad(name='stopgrad', always_on=True)(dense2)
        output2 = Dense(25, name='wanted_dense2')(concatenate(
            [dense1, dense2_stopped]))
        model2 = Model(inputs=input2, outputs=[output2, dense2])
        model2.compile(optimizer=keras.optimizers.SGD(lr=0.1),
                       loss={
                           'wanted_dense2': 'mse',
                           'wanted_dense': zeros_loss
                       })
        weight_b4_train = model2.get_layer(
            name='wanted_dense').get_weights()[0]
        print(model2.uses_learning_phase)
        model2.fit(random_xdata, [random_ydata, random_ydata])
        weight_a4_train = model2.get_layer(
            name='wanted_dense').get_weights()[0]

        # make sure StopGrad does it job to stop gradient backpropation in complicated situation
        self.assertEqual(np.all(weight_a4_train == weight_b4_train), True)
    def model(self):
        input_tensor = Input(shape=self._input_shape, name='input')
        input_tensor_flattened = Flatten()(input_tensor)
        labels_err_tensor = Input(shape=(self._labels_shape, ),
                                  name='labels_err')

        # slice spectra to censor out useless region for elements
        censored_c_input = BoolMask(aspcap_mask("C", dr=14),
                                    name='C_Mask')(input_tensor_flattened)
        censored_c1_input = BoolMask(aspcap_mask("C1", dr=14),
                                     name='C1_Mask')(input_tensor_flattened)
        censored_n_input = BoolMask(aspcap_mask("N", dr=14),
                                    name='N_Mask')(input_tensor_flattened)
        censored_o_input = BoolMask(aspcap_mask("O", dr=14),
                                    name='O_Mask')(input_tensor_flattened)
        censored_na_input = BoolMask(aspcap_mask("Na", dr=14),
                                     name='Na_Mask')(input_tensor_flattened)
        censored_mg_input = BoolMask(aspcap_mask("Mg", dr=14),
                                     name='Mg_Mask')(input_tensor_flattened)
        censored_al_input = BoolMask(aspcap_mask("Al", dr=14),
                                     name='Al_Mask')(input_tensor_flattened)
        censored_si_input = BoolMask(aspcap_mask("Si", dr=14),
                                     name='Si_Mask')(input_tensor_flattened)
        censored_p_input = BoolMask(aspcap_mask("P", dr=14),
                                    name='P_Mask')(input_tensor_flattened)
        censored_s_input = BoolMask(aspcap_mask("S", dr=14),
                                    name='S_Mask')(input_tensor_flattened)
        censored_k_input = BoolMask(aspcap_mask("K", dr=14),
                                    name='K_Mask')(input_tensor_flattened)
        censored_ca_input = BoolMask(aspcap_mask("Ca", dr=14),
                                     name='Ca_Mask')(input_tensor_flattened)
        censored_ti_input = BoolMask(aspcap_mask("Ti", dr=14),
                                     name='Ti_Mask')(input_tensor_flattened)
        censored_ti2_input = BoolMask(aspcap_mask("Ti2", dr=14),
                                      name='Ti2_Mask')(input_tensor_flattened)
        censored_v_input = BoolMask(aspcap_mask("V", dr=14),
                                    name='V_Mask')(input_tensor_flattened)
        censored_cr_input = BoolMask(aspcap_mask("Cr", dr=14),
                                     name='Cr_Mask')(input_tensor_flattened)
        censored_mn_input = BoolMask(aspcap_mask("Mn", dr=14),
                                     name='Mn_Mask')(input_tensor_flattened)
        censored_co_input = BoolMask(aspcap_mask("Co", dr=14),
                                     name='Co_Mask')(input_tensor_flattened)
        censored_ni_input = BoolMask(aspcap_mask("Ni", dr=14),
                                     name='Ni_Mask')(input_tensor_flattened)

        # get neurones from each elements from censored spectra
        c_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2] * 8,
                  kernel_initializer=self.initializer,
                  name='c_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_c_input))
        c1_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='c1_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_c1_input))
        n_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2] * 8,
                  kernel_initializer=self.initializer,
                  name='n_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_n_input))
        o_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='o_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_o_input))
        na_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='na_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_na_input))
        mg_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='mg_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_mg_input))
        al_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='al_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_al_input))
        si_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='si_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_si_input))
        p_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='p_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_p_input))
        s_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='s_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_s_input))
        k_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='k_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_k_input))
        ca_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='ca_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_ca_input))
        ti_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='ti_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_ti_input))
        ti2_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='ti2_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_ti2_input))
        v_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='v_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_v_input))
        cr_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='cr_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_cr_input))
        mn_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='mn_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_mn_input))
        co_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='co_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_co_input))
        ni_dense = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[2],
                  kernel_initializer=self.initializer,
                  name='ni_dense',
                  activation=self.activation,
                  kernel_regularizer=regularizers.l2(
                      self.l2))(censored_ni_input))

        # get neurones from each elements from censored spectra
        c_dense_2 = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[3] * 4,
                  kernel_initializer=self.initializer,
                  activation=self.activation,
                  name='c_dense_2')(c_dense))
        c1_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='c1_dense_2')(c1_dense))
        n_dense_2 = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[3] * 4,
                  kernel_initializer=self.initializer,
                  activation=self.activation,
                  name='n_dense_2')(n_dense))
        o_dense_2 = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[3],
                  kernel_initializer=self.initializer,
                  activation=self.activation,
                  name='o_dense_2')(o_dense))
        na_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='na_dense_2')(na_dense))
        mg_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='mg_dense_2')(mg_dense))
        al_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='al_dense_2')(al_dense))
        si_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='si_dense_2')(si_dense))
        p_dense_2 = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[3],
                  kernel_initializer=self.initializer,
                  activation=self.activation,
                  name='p_dense_2')(p_dense))
        s_dense_2 = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[3],
                  kernel_initializer=self.initializer,
                  activation=self.activation,
                  name='s_dense_2')(s_dense))
        k_dense_2 = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[3],
                  kernel_initializer=self.initializer,
                  activation=self.activation,
                  name='k_dense_2')(k_dense))
        ca_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='ca_dense_2')(ca_dense))
        ti_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='ti_dense_2')(ti_dense))
        ti2_dense_2 = MCDropout(self.dropout_rate,
                                disable=self.disable_dropout)(Dense(
                                    units=self.num_hidden[3],
                                    kernel_initializer=self.initializer,
                                    activation=self.activation,
                                    name='ti2_dense_2')(ti2_dense))
        v_dense_2 = MCDropout(self.dropout_rate, disable=self.disable_dropout)(
            Dense(units=self.num_hidden[3],
                  kernel_initializer=self.initializer,
                  activation=self.activation,
                  name='v_dense_2')(v_dense))
        cr_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='cr_dense_2')(cr_dense))
        mn_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='mn_dense_2')(mn_dense))
        co_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='co_dense_2')(co_dense))
        ni_dense_2 = MCDropout(self.dropout_rate,
                               disable=self.disable_dropout)(Dense(
                                   units=self.num_hidden[3],
                                   kernel_initializer=self.initializer,
                                   activation=self.activation,
                                   name='ni_dense_2')(ni_dense))

        # Basically the same as ApogeeBCNN structure
        cnn_layer_1 = Conv1D(kernel_initializer=self.initializer,
                             padding="same",
                             filters=self.num_filters[0],
                             kernel_size=self.filter_len,
                             kernel_regularizer=regularizers.l2(
                                 self.l2))(input_tensor)
        activation_1 = Activation(activation=self.activation)(cnn_layer_1)
        dropout_1 = MCDropout(self.dropout_rate,
                              disable=self.disable_dropout)(activation_1)
        cnn_layer_2 = Conv1D(kernel_initializer=self.initializer,
                             padding="same",
                             filters=self.num_filters[1],
                             kernel_size=self.filter_len,
                             kernel_regularizer=regularizers.l2(
                                 self.l2))(dropout_1)
        activation_2 = Activation(activation=self.activation)(cnn_layer_2)
        maxpool_1 = MaxPooling1D(pool_size=self.pool_length)(activation_2)
        flattener = Flatten()(maxpool_1)
        dropout_2 = MCDropout(self.dropout_rate,
                              disable=self.disable_dropout)(flattener)
        layer_3 = Dense(units=self.num_hidden[0],
                        kernel_regularizer=regularizers.l2(self.l2),
                        kernel_initializer=self.initializer)(dropout_2)
        activation_3 = Activation(activation=self.activation)(layer_3)
        dropout_3 = MCDropout(self.dropout_rate,
                              disable=self.disable_dropout)(activation_3)
        layer_4 = Dense(units=self.num_hidden[1],
                        kernel_regularizer=regularizers.l2(self.l2),
                        kernel_initializer=self.initializer)(dropout_3)
        activation_4 = Activation(activation=self.activation)(layer_4)
        teff_output = Dense(units=1)(activation_4)
        logg_output = Dense(units=1)(activation_4)
        fe_output = Dense(units=1)(activation_4)
        old_3_output_wo_grad = StopGrad()(concatenate(
            [teff_output, logg_output, fe_output]))

        teff_output_var = Dense(units=1)(activation_4)
        logg_output_var = Dense(units=1)(activation_4)
        fe_output_var = Dense(units=1)(activation_4)

        aux_fullspec = Dense(units=self.num_hidden[4],
                             kernel_initializer=self.initializer,
                             kernel_constraint=MaxNorm(self.maxnorm),
                             name='aux_fullspec')(activation_4)

        fullspec_hidden = concatenate([aux_fullspec, old_3_output_wo_grad])

        # get the final answer
        c_concat = Dense(units=1, name='c_concat')(concatenate(
            [c_dense_2, fullspec_hidden]))
        c1_concat = Dense(units=1, name='c1_concat')(concatenate(
            [c1_dense_2, fullspec_hidden]))
        n_concat = Dense(units=1, name='n_concat')(concatenate(
            [n_dense_2, fullspec_hidden]))
        o_concat = Dense(units=1, name='o_concat')(concatenate(
            [o_dense_2, fullspec_hidden]))
        na_concat = Dense(units=1, name='na_concat')(concatenate(
            [na_dense_2, fullspec_hidden]))
        mg_concat = Dense(units=1, name='mg_concat')(concatenate(
            [mg_dense_2, fullspec_hidden]))
        al_concat = Dense(units=1, name='al_concat')(concatenate(
            [al_dense_2, fullspec_hidden]))
        si_concat = Dense(units=1, name='si_concat')(concatenate(
            [si_dense_2, fullspec_hidden]))
        p_concat = Dense(units=1, name='p_concat')(concatenate(
            [p_dense_2, fullspec_hidden]))
        s_concat = Dense(units=1, name='s_concat')(concatenate(
            [s_dense_2, fullspec_hidden]))
        k_concat = Dense(units=1, name='k_concat')(concatenate(
            [k_dense_2, fullspec_hidden]))
        ca_concat = Dense(units=1, name='ca_concat')(concatenate(
            [ca_dense_2, fullspec_hidden]))
        ti_concat = Dense(units=1, name='ti_concat')(concatenate(
            [ti_dense_2, fullspec_hidden]))
        ti2_concat = Dense(units=1, name='ti2_concat')(concatenate(
            [ti2_dense_2, fullspec_hidden]))
        v_concat = Dense(units=1, name='v_concat')(concatenate(
            [v_dense_2, fullspec_hidden]))
        cr_concat = Dense(units=1, name='cr_concat')(concatenate(
            [cr_dense_2, fullspec_hidden]))
        mn_concat = Dense(units=1, name='mn_concat')(concatenate(
            [mn_dense_2, fullspec_hidden]))
        co_concat = Dense(units=1, name='co_concat')(concatenate(
            [co_dense_2, fullspec_hidden]))
        ni_concat = Dense(units=1, name='ni_concat')(concatenate(
            [ni_dense_2, fullspec_hidden]))

        # get the final predictive uncertainty
        c_concat_var = Dense(units=1, name='c_concat_var')(concatenate(
            [c_dense_2, fullspec_hidden]))
        c1_concat_var = Dense(units=1, name='c1_concat_var')(concatenate(
            [c1_dense_2, fullspec_hidden]))
        n_concat_var = Dense(units=1, name='n_concat_var')(concatenate(
            [n_dense_2, fullspec_hidden]))
        o_concat_var = Dense(units=1, name='o_concat_var')(concatenate(
            [o_dense_2, fullspec_hidden]))
        na_concat_var = Dense(units=1, name='na_concat_var')(concatenate(
            [na_dense_2, fullspec_hidden]))
        mg_concat_var = Dense(units=1, name='mg_concat_var')(concatenate(
            [mg_dense_2, fullspec_hidden]))
        al_concat_var = Dense(units=1, name='al_concat_var')(concatenate(
            [al_dense_2, fullspec_hidden]))
        si_concat_var = Dense(units=1, name='si_concat_var')(concatenate(
            [si_dense_2, fullspec_hidden]))
        p_concat_var = Dense(units=1, name='p_concat_var')(concatenate(
            [p_dense_2, fullspec_hidden]))
        s_concat_var = Dense(units=1, name='s_concat_var')(concatenate(
            [s_dense_2, fullspec_hidden]))
        k_concat_var = Dense(units=1, name='k_concat_var')(concatenate(
            [k_dense_2, fullspec_hidden]))
        ca_concat_var = Dense(units=1, name='ca_concat_var')(concatenate(
            [ca_dense_2, fullspec_hidden]))
        ti_concat_var = Dense(units=1, name='ti_concat_var')(concatenate(
            [ti_dense_2, fullspec_hidden]))
        ti2_concat_var = Dense(units=1, name='ti2_concat_var')(concatenate(
            [ti2_dense_2, fullspec_hidden]))
        v_concat_var = Dense(units=1, name='v_concat_var')(concatenate(
            [v_dense_2, fullspec_hidden]))
        cr_concat_var = Dense(units=1, name='cr_concat_var')(concatenate(
            [cr_dense_2, fullspec_hidden]))
        mn_concat_var = Dense(units=1, name='mn_concat_var')(concatenate(
            [mn_dense_2, fullspec_hidden]))
        co_concat_var = Dense(units=1, name='co_concat_var')(concatenate(
            [co_dense_2, fullspec_hidden]))
        ni_concat_var = Dense(units=1, name='ni_concat_var')(concatenate(
            [ni_dense_2, fullspec_hidden]))

        # concatenate answer
        output = concatenate([
            teff_output, logg_output, c_concat, c1_concat, n_concat, o_concat,
            na_concat, mg_concat, al_concat, si_concat, p_concat, s_concat,
            k_concat, ca_concat, ti_concat, ti2_concat, v_concat, cr_concat,
            mn_concat, fe_output, co_concat, ni_concat
        ],
                             name='output')

        # concatenate predictive uncertainty
        variance_output = concatenate([
            teff_output_var, logg_output_var, c_concat_var, c1_concat_var,
            n_concat_var, o_concat_var, na_concat_var, mg_concat_var,
            al_concat_var, si_concat_var, p_concat_var, s_concat_var,
            k_concat_var, ca_concat_var, ti_concat_var, ti2_concat_var,
            v_concat_var, cr_concat_var, mn_concat_var, fe_output_var,
            co_concat_var, ni_concat_var
        ],
                                      name='variance_output')

        model = Model(inputs=[input_tensor, labels_err_tensor],
                      outputs=[output, variance_output])
        # new astroNN high performance dropout variational inference on GPU expects single output
        model_prediction = Model(inputs=input_tensor,
                                 outputs=concatenate([output,
                                                      variance_output]))

        variance_loss = mse_var_wrapper(output, labels_err_tensor)
        output_loss = mse_lin_wrapper(variance_output, labels_err_tensor)

        return model, model_prediction, output_loss, variance_loss