Energy
MAgNET: A Graph U-Net Architecture for Mesh-Based Simulations
Deshpande, Saurabh, Bordas, Stéphane P. A., Lengiewicz, Jakub
In many cutting-edge applications, high-fidelity computational models prove too slow to be practical and are thus replaced by much faster surrogate models. Recently, deep learning techniques have become increasingly important in accelerating such predictions. However, they tend to falter when faced with larger and more complex problems. Therefore, this work introduces MAgNET: Multi-channel Aggregation Network, a novel geometric deep learning framework designed to operate on large-dimensional data of arbitrary structure (graph data). MAgNET is built upon the MAg (Multichannel Aggregation) operation, which generalizes the concept of multi-channel local operations in convolutional neural networks to arbitrary non-grid inputs. The MAg layers are interleaved with the proposed novel graph pooling/unpooling operations to form a graph U-Net architecture that is robust and can handle arbitrary complex meshes, efficiently performing supervised learning on large-dimensional graph-structured data. We demonstrate the predictive capabilities of MAgNET for several non-linear finite element simulations and provide open-source datasets and codes to facilitate future research.
3D-Aware Object Goal Navigation via Simultaneous Exploration and Identification
Zhang, Jiazhao, Dai, Liu, Meng, Fanpeng, Fan, Qingnan, Chen, Xuelin, Xu, Kai, Wang, He
Object goal navigation (ObjectNav) in unseen environments is a fundamental task for Embodied AI. Agents in existing works learn ObjectNav policies based on 2D maps, scene graphs, or image sequences. Considering this task happens in 3D space, a 3D-aware agent can advance its ObjectNav capability via learning from fine-grained spatial information. However, leveraging 3D scene representation can be prohibitively unpractical for policy learning in this floor-level task, due to low sample efficiency and expensive computational cost. In this work, we propose a framework for the challenging 3D-aware ObjectNav based on two straightforward sub-policies. The two sub-polices, namely corner-guided exploration policy and category-aware identification policy, simultaneously perform by utilizing online fused 3D points as observation. Through extensive experiments, we show that this framework can dramatically improve the performance in ObjectNav through learning from 3D scene representation. Our framework achieves the best performance among all modular-based methods on the Matterport3D and Gibson datasets, while requiring (up to 30x) less computational cost for training.
BO-Muse: A human expert and AI teaming framework for accelerated experimental design
Gupta, Sunil, Shilton, Alistair, A, Arun Kumar V, Ryan, Shannon, Abdolshah, Majid, Le, Hung, Rana, Santu, Berk, Julian, Rashid, Mahad, Venkatesh, Svetha
Bayesian Optimization (BO) (Shahriari et al., 2015) is a popular sample-efficient optimization technique to solve problems where the objective is expensive. It has been successfully applied in diverse areas (Greenhill et al., 2020) including material discovery (Li et al., 2017), alloy design (Barnett et al., 2020) and molecular design (Gómez-Bombarelli et al., 2018). However, standard BO typically operates tabula rasa, building its model of the objective from minimal priors that do not include domain-specific information. While there has been some progress made incorporating domain-specific knowledge to accelerate BO (Li et al., 2018; Hvarfner et al., 2022) or transfer learning from previous experiments (Shilton et al., 2017), it remains the case that there is a significant corpus of knowledge and expertise that could potentially accelerate BO even further but which remain largely untapped due to the inherent complexities involved in knowledge extraction and exploitation. In particular, this often arises from the fact that experts tend to organize their knowledge in complex schema containing concepts, attributes and relationships (Rousseau, 2001), making the elicitation of relevant expert knowledge, both quantitative and qualitative, a difficult task.
Switching Pushing Skill Combined MPC and Deep Reinforcement Learning for Planar Non-prehensile Manipulation
Zhang, Bo, Huang, Cong, Zhang, Haixu, Bai, Xiaoshan
In this paper, a novel switching pushing skill algorithm is proposed to improve the efficiency of planar non-prehensile manipulation, which draws inspiration from human pushing actions and comprises two sub-problems, i.e., discrete decision-making of pushing point and continuous feedback control of pushing action. In order to solve the sub-problems above, a combination of Model Predictive Control (MPC) and Deep Reinforcement Learning (DRL) method is employed. Firstly, the selection of pushing point is modeled as a Markov decision process,and an off-policy DRL method is used by reshaping the reward function to train the decision-making model for selecting pushing point from a pre-constructed set based on the current state. Secondly, a motion constraint region (MCR) is constructed for the specific pushing point based on the distance from the target, followed by utilizing the MPC controller to regulate the motion of the object within the MCR towards the target pose. The trigger condition for switching the pushing point occurs when the object reaches the boundary of the MCR under the pushing action. Subsequently, the pushing point and the controller are updated iteratively until the target pose is reached. We conducted pushing experiments on four distinct object shapes in both simulated and physical environments to evaluate our method. The results indicate that our method achieves a significantly higher training efficiency, with a training time that is only about 20% of the baseline method while maintaining around the same success rate. Moreover, our method outperforms the baseline method in terms of both training and execution efficiency of pushing operations, allowing for rapid learning of robot pushing skills.
On the Analysis of Computational Delays in Reinforcement Learning-based Rate Adaptation Algorithms
Trancoso, Ricardo, Queiros, Ruben, Fontes, Helder, Campos, Rui
Several research works have applied Reinforcement Learning (RL) algorithms to solve the Rate Adaptation (RA) problem in Wi-Fi networks. The dynamic nature of the radio link requires the algorithms to be responsive to changes in link quality. Delays in the execution of the algorithm may be detrimental to its performance, which in turn may decrease network performance. This aspect has been overlooked in the state of the art. In this paper, we present an analysis of common computational delays in RL-based RA algorithms, and propose a methodology that may be applied to reduce these computational delays and increase the efficiency of this type of algorithms. We apply the proposed methodology to an existing RL-based RA algorithm. The obtained experimental results indicate a reduction of one order of magnitude in the execution time of the algorithm, improving its responsiveness to link quality changes.
Optimal Input Gain: All You Need to Supercharge a Feed-Forward Neural Network
Rane, Chinmay, Tyagi, Kanishka, Malalur, Sanjeev, Shinge, Yash, Manry, Michael
Linear transformation of the inputs alters the training performance of feed-forward networks that are otherwise equivalent. However, most linear transforms are viewed as a pre-processing operation separate from the actual training. Starting from equivalent networks, it is shown that pre-processing inputs using linear transformation are equivalent to multiplying the negative gradient matrix with an autocorrelation matrix per training iteration. Second order method is proposed to find the autocorrelation matrix that maximizes learning in a given iteration. When the autocorrelation matrix is diagonal, the method optimizes input gains. This optimal input gain (OIG) approach is used to improve two first-order two-stage training algorithms, namely back-propagation (BP) and hidden weight optimization (HWO), which alternately update the input weights and solve linear equations for output weights. Results show that the proposed OIG approach greatly enhances the performance of the first-order algorithms, often allowing them to rival the popular Levenberg-Marquardt approach with far less computation. It is shown that HWO is equivalent to BP with Whitening transformation applied to the inputs. HWO effectively combines Whitening transformation with learning. Thus, OIG improved HWO could be a significant building block to more complex deep learning architectures.
Can ChatGPT be used to generate scientific hypotheses?
Park, Yang Jeong, Kaplan, Daniel, Ren, Zhichu, Hsu, Chia-Wei, Li, Changhao, Xu, Haowei, Li, Sipei, Li, Ju
We investigate whether large language models can perform the creative hypothesis generation that human researchers regularly do. While the error rate is high, generative AI seems to be able to effectively structure vast amounts of scientific knowledge and provide interesting and testable hypotheses. The future scientific enterprise may include synergistic efforts with a swarm of "hypothesis machines", challenged by automated experimentation and adversarial peer reviews. In a university or research institute, a significant portion of fresh ideas arises out of discussions.
Utilizing Remote Sensing to Analyze Land Usage and Rice Planting Patterns
In particular, a spatial patterning is observed which is heavily reliant on the farmer's decision to plant crops as well as the response from physical environment like pest damage and water shortage. In their paper, Lansing et al. [1] proposed an evolutionary game theoretic model to infer particular power laws governing this spatial patterning along the Bali region. Figure 1 illustrates a snapshot of rice patches in Bali with colors to indicate the different stages of rice growth. The hypothesis presented by the authors suggest that the complex dichotomy between the human actions and the ecology reaches an optimal state where the harvests are maximized in a non-cooperative game. By experimentation, the authors articulate that the adaptation in a tightly coupled human-natural system can trigger a self-organization pattern [2].
NN-Copula-CD: A Copula-Guided Interpretable Neural Network for Change Detection in Heterogeneous Remote Sensing Images
Li, Weiming, Wang, Xueqian, Li, Gang
Change detection (CD) in heterogeneous remote sensing images is a practical and challenging issue for real-life emergencies. In the past decade, the heterogeneous CD problem has significantly benefited from the development of deep neural networks (DNN). However, the data-driven DNNs always perform like a black box where the lack of interpretability limits the trustworthiness and controllability of DNNs in most practical CD applications. As a strong knowledge-driven tool to measure correlation between random variables, Copula theory has been introduced into CD, yet it suffers from non-robust CD performance without manual prior selection for Copula functions. To address the above issues, we propose a knowledge-data-driven heterogeneous CD method (NN-Copula-CD) based on the Copula-guided interpretable neural network. In our NN-Copula-CD, the mathematical characteristics of Copula are designed as the losses to supervise a simple fully connected neural network to learn the correlation between bi-temporal image patches, and then the changed regions are identified via binary classification for the correlation coefficients of all image patch pairs of the bi-temporal images. We conduct in-depth experiments on three datasets with multimodal images (e.g., Optical, SAR, and NIR), where the quantitative results and visualized analysis demonstrate both the effectiveness and interpretability of the proposed NN-Copula-CD.
Deep neural operator for learning transient response of interpenetrating phase composites subject to dynamic loading
Lu, Minglei, Mohammadi, Ali, Meng, Zhaoxu, Meng, Xuhui, Li, Gang, Li, Zhen
Additive manufacturing has been recognized as an industrial technological revolution for manufacturing, which allows fabrication of materials with complex three-dimensional (3D) structures directly from computer-aided design models. The mechanical properties of interpenetrating phase composites (IPCs), especially response to dynamic loading, highly depend on their 3D structures. In general, for each specified structural design, it could take hours or days to perform either finite element analysis (FEA) or experiments to test the mechanical response of IPCs to a given dynamic load. To accelerate the physics-based prediction of mechanical properties of IPCs for various structural designs, we employ a deep neural operator (DNO) to learn the transient response of IPCs under dynamic loading as surrogate of physics-based FEA models. We consider a 3D IPC beam formed by two metals with a ratio of Young's modulus of 2.7, wherein random blocks of constituent materials are used to demonstrate the generality and robustness of the DNO model. To obtain FEA results of IPC properties, 5,000 random time-dependent strain loads generated by a Gaussian process kennel are applied to the 3D IPC beam, and the reaction forces and stress fields inside the IPC beam under various loading are collected. Subsequently, the DNO model is trained using an incremental learning method with sequence-to-sequence training implemented in JAX, leading to a 100X speedup compared to widely used vanilla deep operator network models. After an offline training, the DNO model can act as surrogate of physics-based FEA to predict the transient mechanical response in terms of reaction force and stress distribution of the IPCs to various strain loads in one second at an accuracy of 98%. Also, the learned operator is able to provide extended prediction of the IPC beam subject to longer random strain loads at a reasonably well accuracy.