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Robust SDE-Based Variational Formulations for Solving Linear PDEs via Deep Learning (ICML 2022)

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Robust SDE-Based Variational Formulations for Solving Linear PDEs via Deep Learning

Accompanying code for ICML 2022 paper (Poster). Improved DL-based solvers for linear Kolmogorov PDEs using variance-reduced losses. Implemented in PyTorch, experiment execution and tracking using Weights & Biases.

Illustration

Setup

This code was tested with Python 3.9.7. All necessary packages are specified in requirements.txt and can be installed with:

pip install -r requirements.txt.

You can test your setup by running python main.py.

Quick start

Our code logs all metrics, plots, and model files to Weights & Biases (W&B). By default, this is saved to an anonymous account, the link of which can be found in the output of the code.

We specify our configs using .yaml files in the folder configs, which can be passed to the code using the environment variable WANDB_CONFIG_PATHS (comma-separated list, updated in order).

Example: Learn the 50-dimensional heat equation using the base configuration, a Multilevel net, and the Feynman-Kac loss:

WANDB_CONFIG_PATHS=configs/base.yaml,configs/problems/heat_50d.yaml,configs/models/mlnet.yaml,configs/solver/fk.yaml python main.py.

Sweeps

In order to run experiments for a number of configurations, we use W&B sweeps.

First, define a sweep and copy the <entity>/<project>/<id> string as specified in the output:

wandb sweep configs/sweeps/scaling_sweep.yaml.

Example: To solve the heat equation as above with different batch sizes and losses, one can start several agents with the following command:

WANDB_CONFIG_PATHS=configs/base.yaml,configs/problems/heat_50d.yaml,configs/models/mlnet.yaml wandb agent <entity>/<project>/<id>.

This iteratively pulls configurations from the W&B server and starts the corresponding experiment.

Advanced Configuration

Change .env to set up a suitable environment which will be automatically loaded in main.py. In doing so, you can log metrics to your personal W&B account. You can also change this file with the dotenv package:

dotenv set WANDB_PROJECT <wandb project name>
dotenv set WANDB_ENTITY <wandb username or teamname>
dotenv set WANDB_API_KEY <wandb api key>
dotenv set WANDB_ANONYMOUS allow

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