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Inverse Protein Folding (IPF) is a critical subtask in the field of protein design, aiming to engineer amino acid sequences capable of folding correctly into a specified three-dimensional (3D) conformation. Although substantial progress has…

Computation and Language · Computer Science 2025-05-20 Yanting Li , Jiyue Jiang , Zikang Wang , Ziqian Lin , Dongchen He , Yuheng Shan , Yanruisheng Shao , Jiayi Li , Xiangyu Shi , Jiuming Wang , Yanyu Chen , Yimin Fan , Han Li , Yu Li

Face recognition systems have raised concerns due to their vulnerability to different presentation attacks, and system security has become an increasingly critical concern. Although many face anti-spoofing (FAS) methods perform well in…

Computer Vision and Pattern Recognition · Computer Science 2024-01-03 Zhe Kong , Wentian Zhang , Tao Wang , Kaihao Zhang , Yuexiang Li , Xiaoying Tang , Wenhan Luo

Due to the unobservability of confoundings, there has been widespread concern about how to compute causality quantitatively. To address this challenge, proxy-based negative control approaches have been commonly adopted, where auxiliary…

Optimization and Control · Mathematics 2022-11-09 Zhiheng Zhang

Value-based static analysis techniques express computed program invariants as logical formula over program variables. Researchers and practitioners use these invariants to aid in software engineering and verification tasks. When selecting…

Logic in Computer Science · Computer Science 2024-04-26 Kenny Ballou , Elena Sherman

Identifying novel drug-target interactions (DTI) is a critical and rate limiting step in drug discovery. While deep learning models have been proposed to accelerate the identification process, we show that state-of-the-art models fail to…

We propose a novel method for the determination of the effective interaction potential between the amino acids of a protein. The strategy is based on the combination of a new optimization procedure and a geometrical argument, which also…

Soft Condensed Matter · Physics 2009-10-31 Jort van Mourik , Cecilia Clementi , Amos Maritan , Flavio Seno , J. R. Banavar

Attribute exploration is a method from Formal Concept Analysis (FCA) that helps a domain expert discover structural dependencies in knowledge domains which can be represented as formal contexts (cross tables of objects and attributes). In…

Artificial Intelligence · Computer Science 2022-09-21 Maximilian Felde , Gerd Stumme

Domain generalization (DG), aiming at models able to work on multiple unseen domains, is a must-have characteristic of general artificial intelligence. DG based on single source domain training data is more challenging due to the lack of…

Computer Vision and Pattern Recognition · Computer Science 2023-04-17 Qingyue Yang , Hongjing Niu , Pengfei Xia , Wei Zhang , Bin Li

The spatio-temporal organization of proteins and the associated morphological changes in membranes are of importance in cell signaling. Several mechanisms that promote the aggregation of proteins at low cell surface concentrations have been…

Biological Physics · Physics 2018-04-18 K. K. Sreeja , P. B. Sunil Kumar

The rapid advancement of deepfake technologies has sparked widespread public concern, particularly as face forgery poses a serious threat to public information security. However, the unknown and diverse forgery techniques, varied facial…

Computer Vision and Pattern Recognition · Computer Science 2024-11-22 Zhengchao Huang , Bin Xia , Zicheng Lin , Zhun Mou , Wenming Yang , Jiaya Jia

With the rapid evolution of social media, fake news has become a significant social problem, which cannot be addressed in a timely manner using manual investigation. This has motivated numerous studies on automating fake news detection.…

Computation and Language · Computer Science 2021-02-25 Amila Silva , Ling Luo , Shanika Karunasekera , Christopher Leckie

Complex word identification (CWI) is a cornerstone process towards proper text simplification. CWI is highly dependent on context, whereas its difficulty is augmented by the scarcity of available datasets which vary greatly in terms of…

Computation and Language · Computer Science 2022-05-17 George-Eduard Zaharia , Răzvan-Alexandru Smădu , Dumitru-Clementin Cercel , Mihai Dascalu

The recent prevalence of publicly accessible, large medical imaging datasets has led to a proliferation of artificial intelligence (AI) models for cardiovascular image classification and analysis. At the same time, the potentially…

Human-Computer Interaction · Computer Science 2024-04-26 Grace Guo , Lifu Deng , Animesh Tandon , Alex Endert , Bum Chul Kwon

Causal discovery serves a pivotal role in mitigating model uncertainty through recovering the underlying causal mechanisms among variables. In many practical domains, such as healthcare, access to the data gathered by individual entities is…

Machine Learning · Computer Science 2024-02-13 Amin Abyaneh , Nino Scherrer , Patrick Schwab , Stefan Bauer , Bernhard Schölkopf , Arash Mehrjou

The integration of deep learning approaches in biomedical research has been transformative, enabling breakthroughs in various applications. Despite these strides, its application in protein inference is impeded by the scarcity of…

Machine Learning · Computer Science 2026-05-07 Zheng Ma , Jiazhen Chen , Lei Xin , Ali Ghodsi

Identification of protein-protein interactions (PPIs) helps derive cellular mechanistic understanding, particularly in the context of complex conditions such as neurodegenerative disorders, metabolic syndromes, and cancer. Large Language…

Machine Learning · Computer Science 2025-08-18 Sanket Jantre , Tianle Wang , Gilchan Park , Kriti Chopra , Nicholas Jeon , Xiaoning Qian , Nathan M. Urban , Byung-Jun Yoon

The field of statistical relational learning aims at unifying logic and probability to reason and learn from data. Perhaps the most successful paradigm in the field is probabilistic logic programming: the enabling of stochastic primitives…

Machine Learning · Computer Science 2018-09-20 Stefanie Speichert , Vaishak Belle

Direct-Coupling Analysis is a group of methods to harvest information about coevolving residues in a protein family by learning a generative model in an exponential family from data. In protein families of realistic size, this learning can…

Quantitative Methods · Quantitative Biology 2014-09-16 Magnus Ekeberg , Tuomo Hartonen , Erik Aurell

We present a novel dual-head deep learning architecture for protein-protein interaction modeling that enables simultaneous prediction of binding affinity ($\Delta G$) and mutation-induced affinity changes ($\Delta\Delta G$) using only…

Quantitative Methods · Quantitative Biology 2025-09-30 Supantha Dey , Ratul Chowdhury

Fine-Grained Domain Generalization (FGDG) presents greater challenges than conventional domain generalization due to the subtle inter-class differences and relatively pronounced intra-class variations inherent in fine-grained recognition…

Computer Vision and Pattern Recognition · Computer Science 2026-01-07 Zhen Wang , Jiaojiao Zhao , Qilong Wang , Yongfeng Dong , Wenlong Yu
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