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Understanding our environment, and predicting how it will evolve is one of the key challenges of humankind.
A key tool for achieving these goals are simulations, and the next generation of simulation algorithms
will rely heavily on deep learning components to yield even more accurate predictions about our world.
A key tool for achieving these goals are simulations, and next-gen simulations
could strongly profit from integrating deep learning components to make even
more accurate predictions about our world.
```
## Motivation
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using numerical analysis to obtain solutions for physical models has
become an integral part of science.
At the same time, machine learning technologies and deep neural networks in particular,
In recent years, machine learning technologies and _deep neural networks_ in particular,
have led to impressive achievements in a variety of fields:
from image classification {cite}`krizhevsky2012` over
natural language processing {cite}`radford2019language`,
and more recently also for protein folding {cite}`alquraishi2019alphafold`.
The field is very vibrant and quickly developing, with the promise of vast possibilities.
On the other hand, the successes of deep learning (DL) approaches
These success stories of deep learning (DL) approaches
have given rise to concerns that this technology has
the potential to replace the traditional, simulation-driven approach to
science. Instead of relying on models that are carefully crafted
the potential to replace the traditional, simulation-driven approach to science.
E.g., recent works show that NN-based surrogate models achieve accuracies required
for real-world, industrial applications such as airfoil flows {cite}`chen2021highacc`, while at the
same time outperforming traditional solvers by orders of magnitude in terms of runtime.
Instead of relying on models that are carefully crafted
from first principles, can data collections of sufficient size
be processed to provide the correct answers?
In short: this concern is unfounded. As we'll show in the next chapters,
it is crucial to bring together both worlds: _classical numerical techniques_
and _deep learning_.
As we'll show in the next chapters, this concern is unfounded.
Rather, it is crucial for the next generation of simulation systems
to bridge both worlds: to
combine _classical numerical_ techniques with _deep learning_ methods.
One central reason for the importance of this combination is
that DL approaches are simply not yet powerful enough by themselves.
Given the current state of the art, the clear breakthroughs of DL
in physical applications are outstanding.
The proposed techniques are novel, sometimes difficult to apply, and
significant practical difficulties combing physics and DL persist.
Also, many fundamental theoretical questions remain unaddressed, most importantly
regarding data efficiency and generalization.
that DL approaches are powerful, but at the same time strongly profit
from domain knowledge in the form of physical models.
DL techniques and NNs are novel, sometimes difficult to apply, and
it is admittedly often non-trivial to properly integrate our understanding
of physical processes into the learning algorithms.
Over the course of the last decades,
highly specialized and accurate discretization schemes have
@@ -66,15 +70,15 @@ is highly beneficial for DL to use them as much as possible.
```{admonition} Goals of this document
:class: tip
The key aspects that we want to address in the following are:
- explain how to use deep learning techniques,
- explain how to use deep learning techniques to solve PDE problems,
- how to combine them with **existing knowledge** of physics,
- without **throwing away** our knowledge about numerical methods.
- without **discarding** our knowledge about numerical methods.
```
Thus, we want to build on all the powerful techniques that we have
Thus, our aim is to build on all the powerful techniques that we have
at our disposal, and use them wherever we can.
I.e., our goal is to _reconcile_ the data-centered
viewpoint and the physical simulation viewpoint.
As such, a central goal of this book is to _reconcile_ the data-centered
viewpoint with physical simulations.
The resulting methods have a huge potential to improve
what can be done with numerical methods: in scenarios