467 research outputs found
A Generative Model For Zero Shot Learning Using Conditional Variational Autoencoders
Zero shot learning in Image Classification refers to the setting where images
from some novel classes are absent in the training data but other information
such as natural language descriptions or attribute vectors of the classes are
available. This setting is important in the real world since one may not be
able to obtain images of all the possible classes at training. While previous
approaches have tried to model the relationship between the class attribute
space and the image space via some kind of a transfer function in order to
model the image space correspondingly to an unseen class, we take a different
approach and try to generate the samples from the given attributes, using a
conditional variational autoencoder, and use the generated samples for
classification of the unseen classes. By extensive testing on four benchmark
datasets, we show that our model outperforms the state of the art, particularly
in the more realistic generalized setting, where the training classes can also
appear at the test time along with the novel classes
Foundations and modelling of dynamic networks using Dynamic Graph Neural Networks: A survey
Dynamic networks are used in a wide range of fields, including social network
analysis, recommender systems, and epidemiology. Representing complex networks
as structures changing over time allow network models to leverage not only
structural but also temporal patterns. However, as dynamic network literature
stems from diverse fields and makes use of inconsistent terminology, it is
challenging to navigate. Meanwhile, graph neural networks (GNNs) have gained a
lot of attention in recent years for their ability to perform well on a range
of network science tasks, such as link prediction and node classification.
Despite the popularity of graph neural networks and the proven benefits of
dynamic network models, there has been little focus on graph neural networks
for dynamic networks. To address the challenges resulting from the fact that
this research crosses diverse fields as well as to survey dynamic graph neural
networks, this work is split into two main parts. First, to address the
ambiguity of the dynamic network terminology we establish a foundation of
dynamic networks with consistent, detailed terminology and notation. Second, we
present a comprehensive survey of dynamic graph neural network models using the
proposed terminologyComment: 28 pages, 9 figures, 8 table
Machine Learning in Molecular Dynamics Simulations of Biomolecular Systems
Machine learning (ML) has emerged as a pervasive tool in science,
engineering, and beyond. Its success has also led to several synergies with
molecular dynamics (MD) simulations, which we use to identify and characterize
the major metastable states of molecular systems. Typically, we aim to
determine the relative stabilities of these states and how rapidly they
interchange. This information allows mechanistic descriptions of molecular
mechanisms, enables a quantitative comparison with experiments, and facilitates
their rational design. ML impacts all aspects of MD simulations -- from
analyzing the data and accelerating sampling to defining more efficient or more
accurate simulation models.Comment: 36 pages, 4 figure
- …