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The random phase approximation (RPA) as formulated as an orbital-dependent, fifth-rung functional within the density functional theory (DFT) framework offers a promising approach for calculating the ground-state energies and the derived…

Computational Physics · Physics 2023-07-25 Rong Shi , Peize Lin , Min-Ye Zhang , Lixin He , Xinguo Ren

We construct and study an extended random matrix model of RNA (polymer) folding. A perturbation which acts on all the nucleotides in the chain is added to the action of the RNA partition function. The effect of this perturbation on the…

Statistical Mechanics · Physics 2008-04-23 Itty Garg , N. Deo

Double excitations are crucial to understanding numerous chemical, physical, and biological processes, but accurately predicting them remains a challenge. In this work, we explore the particle-particle random phase approximation (ppRPA) as…

Chemical Physics · Physics 2024-11-26 Jincheng Yu , Jiachen Li , Tianyu Zhu , Weitao Yang

Automatically extracting Protein-Protein Interactions (PPI) from biomedical literature provides additional support for precision medicine efforts. This paper proposes a novel memory network-based model (MNM) for PPI extraction, which…

Computation and Language · Computer Science 2020-01-08 Huiwei Zhou , Zhuang Liu , Shixian Ning , Yunlong Yang , Chengkun Lang , Yingyu Lin , Kun Ma

The Human Genome Project has led to an exponential increase in data related to the sequence, structure, and function of biomolecules. Bioinformatics is an interdisciplinary research field that primarily uses computational methods to analyze…

Biomolecules · Quantitative Biology 2024-05-14 Yanlin Zhou , Tong Zhan , Yichao Wu , Bo Song , Chenxi Shi

Computational discovery of microRNAs (miRNA) is based on pre-determined sets of features from miRNA precursors (pre-miRNA). These feature sets used by current tools for pre-miRNA recognition differ in construction and dimension. Some…

Quantitative Methods · Quantitative Biology 2014-03-19 Ivani de O. N. Lopes , Alexander Schliep , André P. L. F. de Carvalho

Let \pi be a partition. In [2] we defined BG-rank(\pi) as an alternating sum of parities of parts. This statistic was employed to generalize and refine the famous Ramanujan modulo 5 partition congruence. Let p_j(n)(a_{t,j}(n)) denote a…

Combinatorics · Mathematics 2007-05-23 Alexander Berkovich , Frank G. Garvan

Predicting protein interactions is one of the more interesting challenges of the post-genomic era. Many algorithms address this problem as a binary classification problem: given two proteins represented as two vectors of features, predict…

Molecular Networks · Quantitative Biology 2011-11-01 Ossnat Bar-Shira , Gal Chechik

Item Response Theory (IRT) and Factor Analysis (FA) are two major frameworks used to model multi-item measurements of latent traits. While the relationship between two-parameter IRT models and dichotomized FA models is well established, IRT…

Methodology · Statistics 2025-07-03 Ján Pavlech , Patrícia Martinková

Since proteins carry out biological processes by interacting with other proteins, analyzing the structure of protein-protein interaction (PPI) networks could explain complex biological mechanisms, evolution, and disease. Similarly, studying…

Molecular Networks · Quantitative Biology 2010-04-22 Vesna Memisevic , Tijana Milenkovic , Natasa Przulj

Many methods have been proposed for removing batch effects and aligning single-cell RNA (scRNA) datasets. However, performance is typically evaluated based on multiple parameters and few datasets, creating challenges in assessing which…

Machine Learning · Computer Science 2025-03-27 Juan Javier Diaz-Mejia , Elias Williams , Octavian Focsa , Dylan Mendonca , Swechha Singh , Brendan Innes , Sam Cooper

This paper deals with the following important research question. Traditionally, the neural network employs non-linear activation functions concatenated with linear operators to approximate a given physical phenomenon. They "fill the space"…

Numerical Analysis · Mathematics 2022-01-05 Kamil Doległo , Anna Paszyńska , Maciej Paszyński , Leszek Demkowicz

Complexes of physically interacting proteins constitute fundamental functional units responsible for driving biological processes within cells. A faithful reconstruction of the entire set of complexes is therefore essential to understand…

Molecular Networks · Quantitative Biology 2015-05-21 Sriganesh Srihari , Chern Han Yong , Ashwini Patil , Limsoon Wong

Drug-drug interaction (DDI) is a vital information when physicians and pharmacists intend to co-administer two or more drugs. Thus, several DDI databases are constructed to avoid mistakenly combined use. In recent years, automatically…

Computation and Language · Computer Science 2017-05-19 Zibo Yi , Shasha Li , Jie Yu , Qingbo Wu

Numerous physical systems are described by ordinary or partial differential equations whose solutions are given by holomorphic or meromorphic functions in the complex domain. In many cases, only the magnitude of these functions are observed…

Machine Learning · Computer Science 2021-11-29 Juncheng Dong , Simiao Ren , Yang Deng , Omar Khatib , Jordan Malof , Mohammadreza Soltani , Willie Padilla , Vahid Tarokh

Protein-Protein Interactions (PPIs) are fundamental in various biological processes and play a key role in life activities. The growing demand and cost of experimental PPI assays require computational methods for efficient PPI prediction.…

Machine Learning · Computer Science 2024-02-23 Lirong Wu , Yijun Tian , Yufei Huang , Siyuan Li , Haitao Lin , Nitesh V Chawla , Stan Z. Li

Objective: To compare different risk-based methods for optimal prediction of treatment effects. Methods: We simulated RCT data using diverse assumptions for the average treatment effect, a baseline prognostic index of risk (PI), the shape…

We describe an approach for the efficient calculation of a large number of four-point correlation functions for various baryon-baryon (BB) channels, which are the primary quantities for studying the nuclear and hyperonic nuclear forces from…

High Energy Physics - Lattice · Physics 2016-09-21 Hidekatsu Nemura

Pre-trained models have brought significant improvements to many NLP tasks and have been extensively analyzed. But little is known about the effect of fine-tuning on specific tasks. Intuitively, people may agree that a pre-trained model…

Computation and Language · Computer Science 2020-06-03 Jie Cai , Zhengzhou Zhu , Ping Nie , Qian Liu

Feature interactions can play a crucial role in recommendation systems as they capture complex relationships between user preferences and item characteristics. Existing methods such as Deep & Cross Network (DCNv2) may suffer from high…

Information Retrieval · Computer Science 2023-06-29 Weijie Zhao , Ping Li