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相关论文: Retrosynthetic Planning with Dual Value Networks

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In this effort we propose a novel approach for reconstructing multivariate functions from training data, by identifying both a suitable network architecture and an initialization using polynomial-based approximations. Training deep neural…

机器学习 · 计算机科学 2019-05-29 Joseph Daws , Clayton G. Webster

Retrosynthesis is the process of determining the set of reactant molecules that can react to form a desired product. Semi-template-based retrosynthesis methods, which imitate the reverse logic of synthesis reactions, first predict the…

机器学习 · 计算机科学 2024-04-01 Frazier N. Baker , Ziqi Chen , Daniel Adu-Ampratwum , Xia Ning

Computer-aided synthesis planning (CASP) algorithms have demonstrated expert-level abilities in planning retrosynthetic routes to molecules of low to moderate complexity. However, current search methods assume the sufficiency of reaching…

人工智能 · 计算机科学 2024-11-04 Kevin Yu , Jihye Roh , Ziang Li , Wenhao Gao , Runzhong Wang , Connor W. Coley

The performance of video prediction has been greatly boosted by advanced deep neural networks. However, most of the current methods suffer from large model sizes and require extra inputs, e.g., semantic/depth maps, for promising…

计算机视觉与模式识别 · 计算机科学 2023-03-27 Xiaotao Hu , Zhewei Huang , Ailin Huang , Jun Xu , Shuchang Zhou

This paper presents a unified framework for codifying and automating optimization strategies to efficiently deploy deep neural networks (DNNs) on resource-constrained hardware, such as FPGAs, while maintaining high performance, accuracy,…

硬件体系结构 · 计算机科学 2026-02-11 Zhiqiang Que , Jose G. F. Coutinho , Ce Guo , Hongxiang Fan , Wayne Luk

In this work, we describe a new approach that uses deep neural networks (DNN) to obtain regularization parameters for solving inverse problems. We consider a supervised learning approach, where a network is trained to approximate the…

数值分析 · 数学 2021-04-15 Babak Maboudi Afkham , Julianne Chung , Matthias Chung

The deployment of deep convolutional neural networks (CNNs) in many real world applications is largely hindered by their high computational cost. In this paper, we propose a novel learning scheme for CNNs to simultaneously 1) reduce the…

计算机视觉与模式识别 · 计算机科学 2017-08-23 Zhuang Liu , Jianguo Li , Zhiqiang Shen , Gao Huang , Shoumeng Yan , Changshui Zhang

Our work focuses on training RL agents on multiple visually diverse environments to improve observational generalization performance. In prior methods, policy and value networks are separately optimized using a disjoint network architecture…

机器学习 · 计算机科学 2023-01-10 Seungyong Moon , JunYeong Lee , Hyun Oh Song

Recent studies in deep learning-based speech separation have proven the superiority of time-domain approaches to conventional time-frequency-based methods. Unlike the time-frequency domain approaches, the time-domain separation systems…

音频与语音处理 · 电气工程与系统科学 2020-03-30 Yi Luo , Zhuo Chen , Takuya Yoshioka

Power distribution networks are approaching their voltage stability boundaries due to the severe voltage violations and the inadequate reactive power reserves caused by the increasing renewable generations and dynamic loads. In the broad…

最优化与控制 · 数学 2022-08-18 Wanjun Huang , Changhong Zhao

Deep learning methods achieve great success recently on many computer vision problems, with image classification and object detection as the prominent examples. In spite of these practical successes, optimization of deep networks remains an…

计算机视觉与模式识别 · 计算机科学 2017-03-21 Kui Jia

In this paper, a deep reinforcement learning (DRL) method is proposed to address the problem of UAV navigation in an unknown environment. However, DRL algorithms are limited by the data efficiency problem as they typically require a huge…

机器人学 · 计算机科学 2020-08-07 Lei He , Nabil Aouf , James F. Whidborne , Bifeng Song

Retrosynthetic planning is a fundamental task in organic chemistry, yet remains challenging due to its combinatorial complexity. To address this, conventional approaches typically rely on hybrid frameworks that combine single-step…

人工智能 · 计算机科学 2026-04-01 Chenyang Zuo , Siqi Fan , Yizhen Luo , Zaiqing Nie

Our proposed deeply-supervised nets (DSN) method simultaneously minimizes classification error while making the learning process of hidden layers direct and transparent. We make an attempt to boost the classification performance by studying…

机器学习 · 统计学 2017-04-26 Chen-Yu Lee , Saining Xie , Patrick Gallagher , Zhengyou Zhang , Zhuowen Tu

We present 3DVNet, a novel multi-view stereo (MVS) depth-prediction method that combines the advantages of previous depth-based and volumetric MVS approaches. Our key idea is the use of a 3D scene-modeling network that iteratively updates a…

计算机视觉与模式识别 · 计算机科学 2021-12-02 Alexander Rich , Noah Stier , Pradeep Sen , Tobias Höllerer

Multi-Task Learning (MTL) has shown its importance at user products for fast training, data efficiency, reduced overfitting etc. MTL achieves it by sharing the network parameters and training a network for multiple tasks simultaneously.…

机器学习 · 计算机科学 2022-12-08 Brijraj Singh , Swati Gupta , Mayukh Das , Praveen Doreswamy Naidu , Sharan Kumar Allur

The Integrated Process Planning and Scheduling (IPPS) problem combines process route planning and shop scheduling to achieve high efficiency in manufacturing and maximize resource utilization, which is crucial for modern manufacturing…

最优化与控制 · 数学 2024-09-04 Hongpei Li , Han Zhang , Ziyan He , Yunkai Jia , Bo Jiang , Xiang Huang , Dongdong Ge

Deep neural networks (DNNs) exploit many layers and a large number of parameters to achieve excellent performance. The training process of DNN models generally handles large-scale input data with many sparse features, which incurs high…

分布式、并行与集群计算 · 计算机科学 2023-06-08 Ji Liu , Zhihua Wu , Dianhai Yu , Yanjun Ma , Danlei Feng , Minxu Zhang , Xinxuan Wu , Xuefeng Yao , Dejing Dou

Procedural planning aims to predict a sequence of actions that transforms an initial visual state into a desired goal, a fundamental ability for intelligent agents operating in complex environments. Existing approaches typically rely on…

计算机视觉与模式识别 · 计算机科学 2026-03-05 Luigi Seminara , Davide Moltisanti , Antonino Furnari

On account of its many successes in inference tasks and denoising applications, Dictionary Learning (DL) and its related sparse optimization problems have garnered a lot of research interest. While most solutions have focused on single…

机器学习 · 计算机科学 2020-10-22 Wen Tang , Emilie Chouzenoux , Jean-Christophe Pesquet , Hamid Krim