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 Scientific Discovery


Pearson-Matthews correlation coefficients for binary and multinary classification and hypothesis testing

arXiv.org Machine Learning

The Pearson-Matthews correlation coefficient (usually abbreviated MCC) is considered to be one of the most useful metrics for the performance of a binary classification or hypothesis testing method (for the sake of conciseness we will use the classification terminology throughout, but the concepts and methods discussed in the paper apply verbatim to hypothesis testing as well). For multinary classification tasks (with more than two classes) the existing extension of MCC, commonly called the $\text{R}_{\text{K}}$ metric, has also been successfully used in many applications. The present paper begins with an introductory discussion on certain aspects of MCC. Then we go on to discuss the topic of multinary classification that is the main focus of this paper and which, despite its practical and theoretical importance, appears to be less developed than the topic of binary classification. Our discussion of the $\text{R}_{\text{K}}$ is followed by the introduction of two other metrics for multinary classification derived from the multivariate Pearson correlation (MPC) coefficients. We show that both $\text{R}_{\text{K}}$ and the MPC metrics suffer from the problem of not decisively indicating poor classification results when they should, and introduce three new enhanced metrics that do not suffer from this problem. We also present an additional new metric for multinary classification which can be viewed as a direct extension of MCC.


Automated Scientific Discovery: From Equation Discovery to Autonomous Discovery Systems

arXiv.org Artificial Intelligence

The paper surveys automated scientific discovery, from equation discovery and symbolic regression to autonomous discovery systems and agents. It discusses the individual approaches from a "big picture" perspective and in context, but also discusses open issues and recent topics like the various roles of deep neural networks in this area, aiding in the discovery of human-interpretable knowledge. Further, we will present closed-loop scientific discovery systems, starting with the pioneering work on the Adam system up to current efforts in fields from material science to astronomy. Finally, we will elaborate on autonomy from a machine learning perspective, but also in analogy to the autonomy levels in autonomous driving. The maximal level, level five, is defined to require no human intervention at all in the production of scientific knowledge. Achieving this is one step towards solving the Nobel Turing Grand Challenge to develop AI Scientists: AI systems capable of making Nobel-quality scientific discoveries highly autonomously at a level comparable, and possibly superior, to the best human scientists by 2050.


METAM: Goal-Oriented Data Discovery

arXiv.org Artificial Intelligence

Data is a central component of machine learning and causal inference tasks. The availability of large amounts of data from sources such as open data repositories, data lakes and data marketplaces creates an opportunity to augment data and boost those tasks' performance. However, augmentation techniques rely on a user manually discovering and shortlisting useful candidate augmentations. Existing solutions do not leverage the synergy between discovery and augmentation, thus under exploiting data. In this paper, we introduce METAM, a novel goal-oriented framework that queries the downstream task with a candidate dataset, forming a feedback loop that automatically steers the discovery and augmentation process. To select candidates efficiently, METAM leverages properties of the: i) data, ii) utility function, and iii) solution set size. We show METAM's theoretical guarantees and demonstrate those empirically on a broad set of tasks. All in all, we demonstrate the promise of goal-oriented data discovery to modern data science applications.


Deep Learning Opacity in Scientific Discovery

#artificialintelligence

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Evaluating Temporal Observation-Based Causal Discovery Techniques Applied to Road Driver Behaviour

arXiv.org Artificial Intelligence

Autonomous robots are required to reason about the behaviour of dynamic agents in their environment. The creation of models to describe these relationships is typically accomplished through the application of causal discovery techniques. However, as it stands observational causal discovery techniques struggle to adequately cope with conditions such as causal sparsity and non-stationarity typically seen during online usage in autonomous agent domains. Meanwhile, interventional techniques are not always feasible due to domain restrictions. In order to better explore the issues facing observational techniques and promote further discussion of these topics we carry out a benchmark across 10 contemporary observational temporal causal discovery methods in the domain of autonomous driving. By evaluating these methods upon causal scenes drawn from real world datasets in addition to those generated synthetically we highlight where improvements need to be made in order to facilitate the application of causal discovery techniques to the aforementioned use-cases. Finally, we discuss potential directions for future work that could help better tackle the difficulties currently experienced by state of the art techniques.


Sequential Hypothesis Testing under Stochastic Deadlines

Neural Information Processing Systems

Most models of decision-making in neuroscience assume an infinite horizon, which yields an optimal solution that integrates evidence up to a fixed decision threshold; however, under most experimental as well as naturalistic behavioral settings, the decision has to be made before some finite deadline, which is often experienced as a stochastic quantity, either due to variable external constraints or internal timing uncertainty. In this work, we formulate this problem as sequential hypothesis testing under a stochastic horizon. We use dynamic programming tools to show that, for a large class of deadline distributions, the Bayes-optimal solution requires integrating evidence up to a threshold that declines monotonically over time. We use numerical simulations to illustrate the optimal policy in the special cases of a fixed deadline and one that is drawn from a gamma distribution.


successful-machine-learning-development-requires-a-new-paradigm-thought-leaders

#artificialintelligence

Initiatives using machine learning cannot be treated in the same manner as projects involving conventional software. It's imperative to move quickly so that you can test things, fix issues and test them again. In other words, you must be able to fail quickly – and do so early on in the process. Waiting until later in this process to find issues can end up being very expensive and time-consuming. When developing software using the traditional method, you use decision logic.


A new paradigm for managing data

MIT Technology Review

Regeneron isn't the only company eager to derive more value from its data. Despite the enormous amounts of data they collect and the amount of capital they invest in data management solutions, business leaders are still not benefitting from their data. According to IDC research, 83% of CEOs want their organizations to be more data driven, but they struggle with the cultural and technological changes needed to execute an effective data strategy. In response, many organizations, including Regeneron, are turning to a new form of data architecture as a modern approach to data management. In fact, by 2024, more than three-quarters of current data lake users will be investing in this type of hybrid "data lakehouse" architecture to enhance the value generated from their accumulated data, according to Matt Aslett, a research director with Ventana Research.


Israel declares Persian pottery inscription fake, debunking archaeological breakthrough discoveries

FOX News

Fox News Flash top headlines are here. Check out what's clicking on Foxnews.com. Israel acknowledged on Friday that an inscription in clay found in the country's south bearing the name of Darius the Great, ruler of the ancient Persian Empire, was not authentic. The shard of pottery in question was discovered by a passerby last December and caused a sensation as the first mention of sixth century B.C. empire builder to appear in Israel. After the news broke earlier this week, an expert in ancient Aramaic inscriptions approached the Israel Antiquities Authority to explain that she herself had actually etched those words onto the ancient fragment.


Re-creation of Creations: A New Paradigm for Lyric-to-Melody Generation

arXiv.org Artificial Intelligence

Lyric-to-melody generation is an important task in songwriting, and is also quite challenging due to its unique characteristics: the generated melodies should not only follow good musical patterns, but also align with features in lyrics such as rhythms and structures. These characteristics cannot be well handled by neural generation models that learn lyric-to-melody mapping in an end-to-end way, due to several issues: (1) lack of aligned lyric-melody training data to sufficiently learn lyric-melody feature alignment; (2) lack of controllability in generation to better and explicitly align the lyric-melody features. In this paper, we propose Re-creation of Creations (ROC), a new paradigm for lyric-to-melody generation. ROC generates melodies according to given lyrics and also conditions on user-designated chord progression. It addresses the above issues through a generation-retrieval pipeline. Specifically, our paradigm has two stages: (1) creation stage, where a huge amount of music fragments generated by a neural melody language model are indexed in a database through several key features (e.g., chords, tonality, rhythm, and structural information); (2) re-creation stage, where melodies are re-created by retrieving music fragments from the database according to the key features from lyrics and concatenating best music fragments based on composition guidelines and melody language model scores. ROC has several advantages: (1) It only needs unpaired melody data to train melody language model, instead of paired lyric-melody data in previous models. (2) It achieves good lyric-melody feature alignment in lyric-to-melody generation. Tested by English and Chinese lyrics, ROC outperforms previous neural based lyric-to-melody generation models on both objective and subjective metrics.