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Ligands entering a protein binding pocket essentially compete with water molecules for binding to the protein. Hence, the location and thermodynamic properties of water molecules in protein structures have gained increased attention in the…

Biomolecules · Quantitative Biology 2019-08-28 David Schaller , Szymon Pach , Gerhard Wolber

Diffusion-based virtual try-on methods achieve photorealistic synthesis through cross-attention mechanisms that transfer garment features to target body regions. However, these approaches rely on implicit learning of spatial…

Computer Vision and Pattern Recognition · Computer Science 2026-05-05 Kosuke Takemoto , Takafumi Koshinaka

We present a framework for discriminative sequence classification where the learner works directly in the high dimensional predictor space of all subsequences in the training set. This is possible by employing a new coordinate-descent…

Machine Learning · Computer Science 2010-08-04 Georgiana Ifrim , Carsten Wiuf

Visual localization algorithms, i.e., methods that estimate the camera pose of a query image in a known scene, are core components of many applications, including self-driving cars and augmented / mixed reality systems. State-of-the-art…

Computer Vision and Pattern Recognition · Computer Science 2025-04-25 Vojtech Panek , Qunjie Zhou , Yaqing Ding , Sérgio Agostinho , Zuzana Kukelova , Torsten Sattler , Laura Leal-Taixé

The perception and recognition of the surroundings is one of the essential tasks for a robot. With preliminary knowledge about a target object, it can perform various manipulation tasks such as rolling motion, palpation, and force control.…

Physics sensing plays a central role in many scientific and engineering domains, which inherently involves two coupled tasks: reconstructing dense physical fields from sparse observations and optimizing scattered sensor placements to…

Signal Processing · Electrical Eng. & Systems 2026-05-26 Yuezhou Ma , Haixu Wu , Hang Zhou , Huikun Weng , Jianmin Wang , Mingsheng Long

Computer-Aided Drug Discovery research has proven to be a promising direction in drug discovery. In recent years, Deep Learning approaches have been applied to problems in the domain such as Drug-Target Interaction Prediction and have shown…

Machine Learning · Computer Science 2020-04-28 Brighter Agyemang , Wei-Ping Wu , Michael Y. Kpiebaareh , Ebenezer Nanor

Understanding the physical structure is essential for real-world applications such as embodied agents, interactive design, and long-horizon manipulation. Yet, prevailing Vision-Language Model (VLM) evaluations still center on…

Computer Vision and Pattern Recognition · Computer Science 2026-02-25 Yuhao Wu , Maojia Song , Yihuai Lan , Lei Wang , Zhiqiang Hu , Yao Xiao , Heng Zhou , Weihua Zheng , Dylan Raharja , Soujanya Poria , Roy Ka-Wei Lee

Contact-rich manipulation involves kinematic constraints on the task motion, typically with discrete transitions between these constraints during the task. Allowing the robot to detect and reason about these contact constraints can support…

Robotics · Computer Science 2023-04-05 Christian Hegeler , Filippo Rozzi , Loris Roveda , Kevin Haninger

The tracking-by-detection framework requires a set of positive and negative training samples to learn robust tracking models for precise localization of target objects. However, existing tracking models mostly treat different samples…

Computer Vision and Pattern Recognition · Computer Science 2018-11-28 Xiao Wang , Chenglong Li , Rui Yang , Tianzhu Zhang , Jin Tang , Bin Luo

Force estimation in human-object interactions is crucial for various fields like ergonomics, physical therapy, and sports science. Traditional methods depend on specialized equipment such as force plates and sensors, which makes accurate…

Computer Vision and Pattern Recognition · Computer Science 2025-03-31 Nandakishor M , Vrinda Govind , Anuradha Puthalath , Anzy L , Swathi P S , Aswathi R , Devaprabha A R , Varsha Raj , Midhuna Krishnan K , Akhila Anilkumar T , Yamuna P

This paper introduces key machine learning operations that allow the realization of robust, joint 6D pose estimation of multiple instances of objects either densely packed or in unstructured piles from RGB-D data. The first objective is to…

Robotics · Computer Science 2019-10-14 Chaitanya Mitash , Bowen Wen , Kostas Bekris , Abdeslam Boularias

The last few years have seen the development of numerous deep learning-based protein-ligand docking methods. They offer huge promise in terms of speed and accuracy. However, despite claims of state-of-the-art performance in terms of…

Quantitative Methods · Quantitative Biology 2025-05-05 Martin Buttenschoen , Garrett M. Morris , Charlotte M. Deane

Accurate localization in diverse environments is a fundamental challenge in computer vision and robotics. The task involves determining a sensor's precise position and orientation, typically a camera, within a given space. Traditional…

Computer Vision and Pattern Recognition · Computer Science 2024-07-23 Luca Di Giammarino , Boyang Sun , Giorgio Grisetti , Marc Pollefeys , Hermann Blum , Daniel Barath

Dexterous manipulation of objects in virtual environments with our bare hands, by using only a depth sensor and a state-of-the-art 3D hand pose estimator (HPE), is challenging. While virtual environments are ruled by physics, e.g. object…

Computer Vision and Pattern Recognition · Computer Science 2020-08-10 Guillermo Garcia-Hernando , Edward Johns , Tae-Kyun Kim

Object finding in clutter is a skill that requires perception of the environment and in many cases physical interaction. In robotics, interactive perception defines a set of algorithms that leverage actions to improve the perception of the…

Robotics · Computer Science 2020-06-02 Tonci Novkovic , Remi Pautrat , Fadri Furrer , Michel Breyer , Roland Siegwart , Juan Nieto

In the computer research area, facial expression recognition is a hot research problem. Recent years, the research has moved from the lab environment to in-the-wild circumstances. It is challenging, especially under extreme poses. But…

Computer Vision and Pattern Recognition · Computer Science 2018-11-07 Fei Yang , Qian Zhang , Chi Zheng , Guoping Qiu

Accurate prediction of drug-target binding affinity accelerates drug discovery by prioritizing compounds for experimental validation. Current methods face three limitations: sequence-based approaches discard spatial geometric constraints,…

Machine Learning · Computer Science 2026-04-28 Junxiao Kong , Chupei Tang , Di Wang , Jixiu Zhai , Yi He , Moyu Tang , Tianchi Lu

In this work, we propose a method for object recognition and pose estimation from depth images using convolutional neural networks. Previous methods addressing this problem rely on manifold learning to learn low dimensional viewpoint…

Computer Vision and Pattern Recognition · Computer Science 2019-04-19 Mai Bui , Sergey Zakharov , Shadi Albarqouni , Slobodan Ilic , Nassir Navab

Estimating the 3D poses of hands and objects from a single RGB image is a fundamental yet challenging problem, with broad applications in augmented reality and human-computer interaction. Existing methods largely rely on visual cues alone,…

Computer Vision and Pattern Recognition · Computer Science 2025-11-18 Jun Zhou , Chi Xu , Kaifeng Tang , Yuting Ge , Tingrui Guo , Li Cheng
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