{ "cells": [ { "cell_type": "markdown", "metadata": { "id": "7XNMxdTwURqI" }, "source": [ "# External Callbacks in JAX" ] }, { "cell_type": "markdown", "metadata": { "id": "h6lXo6bSUYGq" }, "source": [ "This guide is a work-in-progress outlining the uses of various callback functions, which allow JAX code to execute certain commands on the host, even while running under `jit`, `vmap`, `grad`, or another transformation.\n", "\n", "This is a work-in-progress, and will be updated soon.\n", "\n", "*TODO(jakevdp, sharadmv): fill-in some simple examples of {func}`jax.pure_callback`, {func}`jax.debug.callback`, {func}`jax.debug.print`, and others.*" ] }, { "cell_type": "markdown", "metadata": { "id": "dF7hoWGQUneJ" }, "source": [ "## Example: `pure_callback` with `custom_jvp`\n", "\n", "One powerful way to take advantage of {func}`jax.pure_callback` is to combine it with {class}`jax.custom_jvp` (see [Custom derivative rules](https://jax.readthedocs.io/en/latest/notebooks/Custom_derivative_rules_for_Python_code.html) for more details on `custom_jvp`).\n", "Suppose we want to create a JAX-compatible wrapper for a scipy or numpy function that is not yet available in the `jax.scipy` or `jax.numpy` wrappers.\n", "\n", "Here, we'll consider creating a wrapper for the Bessel function of the first kind, implemented in `scipy.special.jv`.\n", "We can start by defining a straightforward `pure_callback`:" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "Ge4fNPZdVSJY" }, "outputs": [], "source": [ "import jax\n", "import jax.numpy as jnp\n", "import scipy.special\n", "\n", "def jv(v, z):\n", " v, z = jnp.asarray(v), jnp.asarray(z)\n", "\n", " # Require the order v to be integer type: this simplifies\n", " # the JVP rule below.\n", " assert jnp.issubdtype(v.dtype, jnp.integer)\n", "\n", " # Promote the input to inexact (float/complex).\n", " # Note that jnp.result_type() accounts for the enable_x64 flag.\n", " z = z.astype(jnp.result_type(float, z.dtype))\n", "\n", " # Wrap scipy function to return the expected dtype.\n", " _scipy_jv = lambda v, z: scipy.special.jv(v, z).astype(z.dtype)\n", "\n", " # Define the expected shape & dtype of output.\n", " result_shape_dtype = jax.ShapeDtypeStruct(\n", " shape=jnp.broadcast_shapes(v.shape, z.shape),\n", " dtype=z.dtype)\n", "\n", " # We use vectorize=True because scipy.special.jv handles broadcasted inputs.\n", " return jax.pure_callback(_scipy_jv, result_shape_dtype, v, z, vectorized=True)" ] }, { "cell_type": "markdown", "metadata": { "id": "vyjQj-0QVuoN" }, "source": [ "This lets us call into `scipy.special.jv` from transformed JAX code, including when transformed by `jit` and `vmap`:" ] }, { "cell_type": "code", "execution_count": null, "id": "3b5f2537", "metadata": { "id": "f4e46670f4e4" }, "outputs": [], "source": [ "from functools import partial\n", "j1 = partial(jv, 1)\n", "z = jnp.arange(5.0)" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "6svImqFHWBwj", "outputId": "bc8c778a-6c10-443b-9be2-c0f28e2ac1a9" }, "outputs": [ { "name": "stderr", "output_type": "stream", "text": [ "WARNING:jax._src.lib.xla_bridge:No GPU/TPU found, falling back to CPU. (Set TF_CPP_MIN_LOG_LEVEL=0 and rerun for more info.)\n" ] }, { "name": "stdout", "output_type": "stream", "text": [ "[ 0. 0.44005057 0.5767248 0.33905897 -0.06604332]\n" ] } ], "source": [ "print(j1(z))" ] }, { "cell_type": "markdown", "id": "6a7e548d", "metadata": { "id": "d48eb4f2d48e" }, "source": [ "Here is the same result with `jit`:" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "txvRqR9DWGdC", "outputId": "d25f3476-23b1-48e4-dda1-3c06d32c3b87" }, "outputs": [ { "name": "stdout", "output_type": "stream", "text": [ "[ 0. 0.44005057 0.5767248 0.33905897 -0.06604332]\n" ] } ], "source": [ "print(jax.jit(j1)(z))" ] }, { "cell_type": "markdown", "id": "fc57f541", "metadata": { "id": "d861a472d861" }, "source": [ "And here is the same result again with `vmap`:" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "BS-Ve5u_WU0C", "outputId": "08cecd1f-6953-4853-e9db-25a03eb5b000" }, "outputs": [ { "name": "stdout", "output_type": "stream", "text": [ "[ 0. 0.44005057 0.5767248 0.33905897 -0.06604332]\n" ] } ], "source": [ "print(jax.vmap(j1)(z))" ] }, { "cell_type": "markdown", "metadata": { "id": "SCH2ii_dWXP6" }, "source": [ "However, if we call `jax.grad`, we see an error because there is no autodiff rule defined for this function:" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "q3qh_4DrWxdQ", "outputId": "c46b0bfa-96f3-4629-b9af-a4d4f3ccb870", "tags": [ "raises-exception" ] }, "outputs": [ { "ename": "ValueError", "evalue": "ignored", "output_type": "error", "traceback": [ "\u001b[0;31m---------------------------------------------------------------------------\u001b[0m", "\u001b[0;31mUnfilteredStackTrace\u001b[0m Traceback (most recent call last)", "\u001b[0;32m\u001b[0m in \u001b[0;36m\u001b[0;34m\u001b[0m\n\u001b[0;32m----> 1\u001b[0;31m 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because scipy.special.jv handles broadcasted inputs.\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0;32m---> 25\u001b[0;31m \u001b[0;32mreturn\u001b[0m \u001b[0mjax\u001b[0m\u001b[0;34m.\u001b[0m\u001b[0mpure_callback\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0m_scipy_jv\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mresult_shape_dtype\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mv\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mz\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mvectorized\u001b[0m\u001b[0;34m=\u001b[0m\u001b[0;32mTrue\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0m", "\u001b[0;32m/usr/local/lib/python3.8/dist-packages/jax/_src/api.py\u001b[0m in \u001b[0;36mpure_callback\u001b[0;34m(callback, result_shape_dtypes, *args, **kwargs)\u001b[0m\n\u001b[1;32m 3425\u001b[0m \"\"\"\n\u001b[0;32m-> 3426\u001b[0;31m \u001b[0;32mreturn\u001b[0m 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"\u001b[0;32m/usr/local/lib/python3.8/dist-packages/jax/interpreters/ad.py\u001b[0m in \u001b[0;36mprocess_primitive\u001b[0;34m(self, primitive, tracers, params)\u001b[0m\n\u001b[1;32m 309\u001b[0m \u001b[0;32mraise\u001b[0m \u001b[0mNotImplementedError\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mmsg\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0;32m--> 310\u001b[0;31m \u001b[0mprimal_out\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mtangent_out\u001b[0m \u001b[0;34m=\u001b[0m \u001b[0mjvp\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mprimals_in\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mtangents_in\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0;34m**\u001b[0m\u001b[0mparams\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0m\u001b[1;32m 311\u001b[0m \u001b[0;32mif\u001b[0m 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Please use `jax.custom_jvp` to use callbacks while taking gradients.\n\nThe stack trace below excludes JAX-internal frames.\nThe preceding is the original exception that occurred, unmodified.\n\n--------------------", "\nThe above exception was the direct cause of the following exception:\n", "\u001b[0;31mValueError\u001b[0m Traceback (most recent call last)", "\u001b[0;32m\u001b[0m in \u001b[0;36m\u001b[0;34m\u001b[0m\n\u001b[0;32m----> 1\u001b[0;31m \u001b[0mjax\u001b[0m\u001b[0;34m.\u001b[0m\u001b[0mgrad\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mj1\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mz\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0m", "\u001b[0;32m\u001b[0m in \u001b[0;36mjv\u001b[0;34m(v, z)\u001b[0m\n\u001b[1;32m 23\u001b[0m \u001b[0;34m\u001b[0m\u001b[0m\n\u001b[1;32m 24\u001b[0m \u001b[0;31m# We use vectorize=True because scipy.special.jv handles broadcasted inputs.\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0;32m---> 25\u001b[0;31m \u001b[0;32mreturn\u001b[0m \u001b[0mjax\u001b[0m\u001b[0;34m.\u001b[0m\u001b[0mpure_callback\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0m_scipy_jv\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mresult_shape_dtype\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mv\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mz\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mvectorized\u001b[0m\u001b[0;34m=\u001b[0m\u001b[0;32mTrue\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0m", "\u001b[0;32m/usr/local/lib/python3.8/dist-packages/jax/_src/callback.py\u001b[0m in \u001b[0;36mpure_callback\u001b[0;34m(callback, result_shape_dtypes, vectorized, *args, **kwargs)\u001b[0m\n\u001b[1;32m 129\u001b[0m lambda x: core.ShapedArray(x.shape, x.dtype), result_shape_dtypes)\n\u001b[1;32m 130\u001b[0m \u001b[0mflat_result_avals\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mout_tree\u001b[0m \u001b[0;34m=\u001b[0m \u001b[0mtree_util\u001b[0m\u001b[0;34m.\u001b[0m\u001b[0mtree_flatten\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0mresult_avals\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0;32m--> 131\u001b[0;31m out_flat = pure_callback_p.bind(\n\u001b[0m\u001b[1;32m 132\u001b[0m \u001b[0;34m*\u001b[0m\u001b[0mflat_args\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mcallback\u001b[0m\u001b[0;34m=\u001b[0m\u001b[0m_flat_callback\u001b[0m\u001b[0;34m,\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[1;32m 133\u001b[0m result_avals=tuple(flat_result_avals), vectorized=vectorized)\n", "\u001b[0;32m/usr/local/lib/python3.8/dist-packages/jax/_src/callback.py\u001b[0m in \u001b[0;36mpure_callback_jvp_rule\u001b[0;34m(***failed resolving arguments***)\u001b[0m\n\u001b[1;32m 53\u001b[0m \u001b[0;32mdef\u001b[0m \u001b[0mpure_callback_jvp_rule\u001b[0m\u001b[0;34m(\u001b[0m\u001b[0;34m*\u001b[0m\u001b[0margs\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0;34m**\u001b[0m\u001b[0mkwargs\u001b[0m\u001b[0;34m)\u001b[0m\u001b[0;34m:\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[1;32m 54\u001b[0m \u001b[0;32mdel\u001b[0m \u001b[0margs\u001b[0m\u001b[0;34m,\u001b[0m \u001b[0mkwargs\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[0;32m---> 55\u001b[0;31m raise ValueError(\n\u001b[0m\u001b[1;32m 56\u001b[0m \u001b[0;34m\"Pure callbacks do not support JVP. \"\u001b[0m\u001b[0;34m\u001b[0m\u001b[0;34m\u001b[0m\u001b[0m\n\u001b[1;32m 57\u001b[0m \"Please use `jax.custom_jvp` to use callbacks while taking gradients.\")\n", "\u001b[0;31mValueError\u001b[0m: Pure callbacks do not support JVP. Please use `jax.custom_jvp` to use callbacks while taking gradients." ] } ], "source": [ "jax.grad(j1)(z)" ] }, { "cell_type": "markdown", "metadata": { "id": "PtYeJ_xUW09v" }, "source": [ "Let's define a custom gradient rule for this. Looking at the definition of the [Bessel Function of the First Kind](https://en.wikipedia.org/?title=Bessel_function_of_the_first_kind), we find that there is a relatively straightforward recurrence relationship for the derivative with respect to the argument `z`:\n", "\n", "$$\n", "d J_\\nu(z) = \\left\\{\n", "\\begin{eqnarray}\n", "-J_1(z),\\ &\\nu=0\\\\\n", "[J_{\\nu - 1}(z) - J_{\\nu + 1}(z)]/2,\\ &\\nu\\ne 0\n", "\\end{eqnarray}\\right.\n", "$$\n", "\n", "The gradient with respect to $\\nu$ is more complicated, but since we've restricted the `v` argument to integer types we don't need to worry about its gradient for the sake of this example.\n", "\n", "We can use `jax.custom_jvp` to define this automatic differentiation rule for our callback function:" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "BOVQnt05XvLs" }, "outputs": [], "source": [ "jv = jax.custom_jvp(jv)\n", "\n", "@jv.defjvp\n", "def _jv_jvp(primals, tangents):\n", " v, z = primals\n", " _, z_dot = tangents # Note: v_dot is always 0 because v is integer.\n", " jv_minus_1, jv_plus_1 = jv(v - 1, z), jv(v + 1, z)\n", " djv_dz = jnp.where(v == 0, -jv_plus_1, 0.5 * (jv_minus_1 - jv_plus_1))\n", " return jv(v, z), z_dot * djv_dz" ] }, { "cell_type": "markdown", "metadata": { "id": "W1SxcvQSX44c" }, "source": [ "Now computing the gradient of our function will work correctly:" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "sCGceBs-X8nL", "outputId": "71c5589f-f996-44a0-f09a-ca8bb40c167a" }, "outputs": [ { "name": "stdout", "output_type": "stream", "text": [ "-0.06447162\n" ] } ], "source": [ "j1 = partial(jv, 1)\n", "print(jax.grad(j1)(2.0))" ] }, { "cell_type": "markdown", "metadata": { "id": "gWQ4phN5YB26" }, "source": [ "Further, since we've defined our gradient in terms of `jv` itself, JAX's architecture means that we get second-order and higher derivatives for free:" ] }, { "cell_type": "code", "execution_count": null, "metadata": { "id": "QTe5mRAvYQBh", "outputId": "d58ecff3-9419-422a-fd0e-14a7d9cf2cc3" }, "outputs": [ { "data": { "text/plain": [ "DeviceArray(-0.4003078, dtype=float32, weak_type=True)" ] }, "execution_count": 8, "metadata": {}, "output_type": "execute_result" } ], "source": [ "jax.hessian(j1)(2.0)" ] }, { "cell_type": "markdown", "metadata": { "id": "QEXGxU4uYZii" }, "source": [ "Keep in mind that although this all works correctly with JAX, each call to our callback-based `jv` function will result in passing the input data from the device to the host, and passing the output of `scipy.special.jv` from the host back to the device.\n", "When running on accelerators like GPU or TPU, this data movement and host synchronization can lead to significant overhead each time `jv` is called.\n", "However, if you are running JAX on a single CPU (where the \"host\" and \"device\" are on the same hardware), JAX will generally do this data transfer in a fast, zero-copy fashion, making this pattern is a relatively straightforward way extend JAX's capabilities." ] } ], "metadata": { "colab": { "provenance": [] }, "jupytext": { "formats": "ipynb,md:myst" }, "kernelspec": { "display_name": "Python 3", "name": "python3" } }, "nbformat": 4, "nbformat_minor": 0 }