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  • Article
  • Open Access
2 Citations
2,343 Views
12 Pages

From SARS-CoV-2 to Global Preparedness: A Graphical Interface for Standardised High-Throughput Bioinformatics Analysis in Pandemic Scenarios and Surveillance of Drug Resistance

  • Tomas Cumlin,
  • Ida Karlsson,
  • Jonathan Haars,
  • Maria Rosengren,
  • Johan Lennerstrand,
  • Maryna Pimushyna,
  • Lars Feuk,
  • Claes Ladenvall and
  • Rene Kaden

The COVID-19 pandemic highlighted the need for a rapid, convenient, and scalable diagnostic method for detecting a novel pathogen amidst a global pandemic. While command-line interface tools offer automation for SARS-CoV-2 Oxford Nanopore Technology...

  • Article
  • Open Access
5 Citations
6,337 Views
26 Pages

Usability as the Key Factor to the Design of a Web Server for the CReF Protein Structure Predictor: The wCReF

  • Vanessa Stangherlin Machado Paixão-Cortes,
  • Michele Dos Santos da Silva Tanus,
  • Walter Ritzel Paixão-Cortes,
  • Osmar Norberto De Souza,
  • Marcia De Borba Campos and
  • Milene Selbach Silveira

17 January 2018

Protein structure prediction servers use various computational methods to predict the three-dimensional structure of proteins from their amino acid sequence. Predicted models are used to infer protein function and guide experimental efforts. This can...

  • Article
  • Open Access
2,434 Views
18 Pages

Bioinformatic Analysis of the Leptin–Ob-R Interface: Structural Modeling, Thermodynamic Profiling, and Stability in Diverse Microenvironments

  • Gabriel I. Ortega-López,
  • Francisco Reyes-Espinosa,
  • Víctor Eric López-Y-López and
  • Claudia G. Benítez-Cardoza

Leptin is an adipocyte-derived hormone that orchestrates different physiological processes, including energy balance, thermogenesis, immune regulation, reproduction, and tissue remodeling. These effects are mediated through interaction with the CRH2...

  • Article
  • Open Access
7 Citations
1,806 Views
17 Pages

8 February 2023

Deficit of human ornithine aminotransferase (hOAT), a mitochondrial tetrameric pyridoxal-5′-phosphate (PLP) enzyme, leads to gyrate atrophy of the choroid and retina (GA). Although 70 pathogenic mutations have been identified, only few enzymati...

  • Article
  • Open Access
19 Citations
4,516 Views
17 Pages

22 May 2019

The human operator largely relies on the perception of remote environmental conditions to make timely and correct decisions in a prescribed task when the robot is teleoperated in a remote place. However, due to the unknown and dynamic working environ...

  • Article
  • Open Access
17 Citations
6,234 Views
15 Pages

Structural and Computational Characterization of Disease-Related Mutations Involved in Protein-Protein Interfaces

  • Dàmaris Navío,
  • Mireia Rosell,
  • Josu Aguirre,
  • Xavier de la Cruz and
  • Juan Fernández-Recio

One of the known potential effects of disease-causing amino acid substitutions in proteins is to modulate protein-protein interactions (PPIs). To interpret such variants at the molecular level and to obtain useful information for prediction purposes,...

  • Article
  • Open Access
7 Citations
6,419 Views
13 Pages

Protein–Protein Interfaces: A Graph Neural Network Approach

  • Niccolò Pancino,
  • Caterina Gallegati,
  • Fiamma Romagnoli,
  • Pietro Bongini and
  • Monica Bianchini

Protein–protein interactions (PPIs) are fundamental processes governing cellular functions, crucial for understanding biological systems at the molecular level. Compared to experimental methods for PPI prediction and site identification, comput...

  • Article
  • Open Access
22 Citations
6,290 Views
8 Pages

Although not yet truly ‘comprehensive’, modern mass spectrometry-based experiments can generate quantitative data for a meaningful fraction of the human proteome. Importantly for large-scale protein expression analysis, robust data pipelines are in p...

  • Article
  • Open Access
483 Views
17 Pages

Utilization of a Bioinformatic Approach to Identify Emulsifying Peptides Embedded in Brewers’ Spent Grain Proteins and Characterization of Their Emulsifying Properties

  • Rasmus Kranold Mikkelsen,
  • Ioanna Fragkaki,
  • Simon Gregersen Echers,
  • Naim Abdul-Khalek,
  • Michael Toft Overgaard,
  • Charlotte Jacobsen and
  • Betül Yesiltas

Brewers’ spent grain (BSG) represents the major byproduct of the brewing industry and remains largely underutilized. While BSG contains a rather high amount of protein, poor functional properties limit its use as a functional ingredient for foo...

  • Review
  • Open Access
180 Citations
11,981 Views
16 Pages

27 November 2022

Over the past few decades, the number of available structural bioinformatics pipelines, libraries, plugins, web resources and software has increased exponentially and become accessible to the broad realm of life scientists. This expansion has shaped...

  • Article
  • Open Access
662 Views
22 Pages

Calmodulin Interaction Interface with Plasma Membrane Ca2+-ATPase Isoforms: An Integrative Bioinformatic Analysis

  • Miguel Martínez-Fresneda,
  • Esteban Lizano,
  • Gabriela Echeverría-Garcés,
  • Andres Herrera-Yela,
  • Danna Feijóo,
  • Grecia Victoria Vivas-Colmenares,
  • Alvaro López-Zaplana,
  • Leda Pedelini,
  • Marta Mendoza and
  • Jose Ruben Ramírez-Iglesias
  • + 1 author

4 December 2025

Plasma membrane Ca2+-ATPases (PMCA) are activated by calmodulin (CaM) via a C-terminal calmodulin-binding domain, CaMBD. Although specific mutations in this domain have been linked to disease, the broader impact of alternative substitutions across th...

  • Article
  • Open Access
3,212 Views
17 Pages

A Tutorial Toolbox to Simplify Bioinformatics and Biostatistics Analyses of Microbial Omics Data in an Island Context

  • Isaure Quétel,
  • Sourakhata Tirera,
  • Damien Cazenave,
  • Nina Allouch,
  • Chloé Baum,
  • Yann Reynaud,
  • Degrâce Batantou Mabandza,
  • Virginie Nerrière,
  • Serge Vedy and
  • David Couvin
  • + 5 authors

Background: Bioinformatics is increasingly used in various scientific works. Large amounts of heterogeneous data are being generated these days. It is difficult to interpret and analyze these data effectively. Several software tools have been develop...

  • Communication
  • Open Access
25 Citations
4,721 Views
10 Pages

PepLab Platform: Database and Software Tools for Analysis of Food-Derived Bioactive Peptides

  • Zhelyazko Terziyski,
  • Margarita Terziyska,
  • Ivelina Deseva,
  • Stanka Hadzhikoleva,
  • Albert Krastanov,
  • Dasha Mihaylova and
  • Emil Hadzhikolev

10 January 2023

Research on food-derived bioactive peptides is expanding and the need for a convenient online platform that combines a foolproof and intuitive user interface with a reliable database and tools for prediction and analysis is rising. In this regard, th...

  • Article
  • Open Access
19 Citations
11,990 Views
14 Pages

BacSeq: A User-Friendly Automated Pipeline for Whole-Genome Sequence Analysis of Bacterial Genomes

  • Arnon Chukamnerd,
  • Kongpop Jeenkeawpiam,
  • Sarunyou Chusri,
  • Rattanaruji Pomwised,
  • Kamonnut Singkhamanan and
  • Komwit Surachat

Whole-genome sequencing (WGS) of bacterial pathogens is widely conducted in microbiological, medical, and clinical research to explore genetic insights that could impact clinical treatment and molecular epidemiology. However, analyzing WGS data of ba...

  • Article
  • Open Access
1 Citations
2,396 Views
16 Pages

Practical Design and Implementation of Virtual Chatbot Assistants for Bioinformatics Based on a NLU Open Framework

  • Aya Allah Elsayed,
  • Ahmed Ibrahem Hafez,
  • Raquel Ceprián,
  • Genís Martínez,
  • Alejandro Granados,
  • Beatriz Soriano,
  • Carlos Llorens and
  • José M. Sempere

In this work, we describe the implementation of an infrastructure of conversational chatbots by using natural language processing and training within the Rasa framework. We use this infrastructure to create a chatbot assistant for the users of a bioi...

  • Article
  • Open Access
8 Citations
2,585 Views
12 Pages

Human–computer interaction tends to be intelligent and driven by technological innovation. However, there is a digital divide caused by usage barriers for older users when interacting with complex tasks. To better help elderly users efficiently...

  • Article
  • Open Access
2 Citations
4,733 Views
22 Pages

31 March 2020

The assembly of picornavirus capsids proceeds through the stepwise oligomerization of capsid protein subunits and depends on interactions between critical residues known as hotspots. Few studies have described the identification of hotspot residues a...

  • Article
  • Open Access
8 Citations
6,322 Views
14 Pages

GDS: A Genomic Database for Strawberries (Fragaria spp.)

  • Yuhan Zhou,
  • Yushan Qiao,
  • Zhiyou Ni,
  • Jianke Du,
  • Jinsong Xiong,
  • Zongming Cheng and
  • Fei Chen

Strawberry species (Fragaria spp.) are known as the “queen of fruits” and are cultivated around the world. Over the past few years, eight strawberry genome sequences have been released. The reuse of these large amount of genomic data, and...

  • Article
  • Open Access
4 Citations
3,918 Views
11 Pages

PhenGenVar: A User-Friendly Genetic Variant Detection and Visualization Tool for Precision Medicine

  • JaeMoon Shin,
  • Junbeom Jeon,
  • Dawoon Jung,
  • Kiyong Kim,
  • Yun Joong Kim,
  • Dong-Hoon Jeong and
  • JeeHee Yoon

12 June 2022

Precision medicine has been revolutionized by the advent of high-throughput next-generation sequencing (NGS) technology and development of various bioinformatic analysis tools for large-scale NGS big data. At the population level, biomedical studies...

  • Article
  • Open Access
1 Citations
2,347 Views
16 Pages

1 July 2024

Next Generation Sequencing Technologies (NGS), particularly metabarcoding, are valuable tools for authenticating foodstuffs and detecting eventual fraudulent practices such as species substitution. This technique, mostly used for the analysis of prok...

  • Article
  • Open Access
6 Citations
3,222 Views
22 Pages

11 July 2023

The fungal secretome is the main interface for interactions between the pathogen and its host. It includes the most important virulence factors and effector proteins. We integrated different bioinformatic approaches and used the newly drafted genome...

  • Communication
  • Open Access
144 Views
14 Pages

16 February 2026

In recent years, the use of computational pipelines for the analysis of omic data has become routine in bioinformatics, particularly with the advent of Next-Generation Sequencing (NGS) technologies. These technologies generate vast amounts of data th...

  • Review
  • Open Access
9 Citations
5,652 Views
16 Pages

7 August 2020

Proteins are crucial players of biological interactions within and between the organisms and thus it is important to understand the role of proteins in successful partnerships, such as insect vectors and their plant viruses. Proteomic approaches have...

  • Article
  • Open Access
6 Citations
4,842 Views
10 Pages

CLASH Analyst: A Web Server to Identify In Vivo RNA–RNA Interactions from CLASH Data

  • Wei-Sheng Wu,
  • Jordan S. Brown,
  • Pin-Hao Chen,
  • Sheng-Cian Shiue,
  • Dong-En Lee and
  • Heng-Chi Lee

Non-coding RNAs, such as miRNAs and piRNAs, play critical roles in gene regulation through base-pairing interactions with their target molecules. The recent development of the crosslinking, ligation, and sequencing of hybrids (CLASH) method has allow...

  • Review
  • Open Access
12 Citations
14,961 Views
16 Pages

Empowering Mayo Clinic Individualized Medicine with Genomic Data Warehousing

  • Iain Horton,
  • Yaxiong Lin,
  • Gay Reed,
  • Mathieu Wiepert and
  • Steven Hart

Individualized medicine enables better diagnoses and treatment decisions for patients and promotes research in understanding the molecular underpinnings of disease. Linking individual patient’s genomic and molecular information with their clinical ph...

  • Article
  • Open Access
22 Citations
5,985 Views
23 Pages

Proteomic Interaction Patterns between Human Cyclins, the Cyclin-Dependent Kinase Ortholog pUL97 and Additional Cytomegalovirus Proteins

  • Mirjam Steingruber,
  • Alexandra Kraut,
  • Eileen Socher,
  • Heinrich Sticht,
  • Anna Reichel,
  • Thomas Stamminger,
  • Bushra Amin,
  • Yohann Couté,
  • Corina Hutterer and
  • Manfred Marschall

18 August 2016

The human cytomegalovirus (HCMV)-encoded cyclin-dependent kinase (CDK) ortholog pUL97 associates with human cyclin B1 and other types of cyclins. Here, the question was addressed whether cyclin interaction of pUL97 and additional viral proteins is de...

  • Article
  • Open Access
3 Citations
1,589 Views
22 Pages

Enantioselectivity Enhancement of a Geobacillus thermoleovorans CCR11 Lipase by Rational Design

  • Aaron-Salvador Bustos-Baena,
  • Rodolfo Quintana-Castro,
  • María Guadalupe Sánchez-Otero,
  • Graciela Espinosa-Luna,
  • María Remedios Mendoza-López,
  • Carolina Peña-Montes and
  • Rosa María Oliart-Ros

12 February 2025

Lipases are enzymes that catalyze the hydrolysis of carboxylic esters at a lipid–water interface and are able to catalyze reactions such as alcoholysis, esterification, transesterification, and enantioselective synthesis in organic media. They...

  • Article
  • Open Access
11 Citations
3,168 Views
12 Pages

6 October 2022

NH–π interactions between polar and aromatic residues are well distributed in proteins whose stabilizing effects have been investigated in globular and fibrous proteins. In order to gain structural insights into side chain NH–π inte...

  • Article
  • Open Access
3 Citations
11,387 Views
33 Pages

28 February 2002

A strategy for a new type of platform for chemoinformatics software development and its first implementation are presented. The basic task of such a platform is to apply sequences of computational methods to high numbers of molecules. The implementat...

  • Article
  • Open Access
500 Views
16 Pages

Transformer-Based Classification of Transposable Element Consensus Sequences with TEclass2

  • Lucas Bickmann,
  • Matias Rodriguez,
  • Xiaoyi Jiang and
  • Wojciech Makałowski

29 December 2025

Transposable elements (TEs) constitute a significant portion of eukaryotic genomes and play crucial roles in genome evolution, yet their diverse and complex sequences pose challenges for accurate classification. Existing tools often lack reliability...

  • Article
  • Open Access
22 Citations
7,842 Views
9 Pages

PAST: The Pathway Association Studies Tool to Infer Biological Meaning from GWAS Datasets

  • Adam Thrash,
  • Juliet D. Tang,
  • Mason DeOrnellis,
  • Daniel G. Peterson and
  • Marilyn L. Warburton

2 January 2020

In recent years, a bioinformatics method for interpreting genome-wide association study (GWAS) data using metabolic pathway analysis has been developed and successfully used to find significant pathways and mechanisms explaining phenotypic traits of...

  • Review
  • Open Access
51 Citations
17,446 Views
25 Pages

The lncRNA Toolkit: Databases and In Silico Tools for lncRNA Analysis

  • Holly R. Pinkney,
  • Brandon M. Wright and
  • Sarah D. Diermeier

16 December 2020

Long non-coding RNAs (lncRNAs) are a rapidly expanding field of research, with many new transcripts identified each year. However, only a small subset of lncRNAs has been characterized functionally thus far. To aid investigating the mechanisms of act...

  • Article
  • Open Access
1 Citations
1,597 Views
20 Pages

23 October 2024

Background: N6-methyladenosine (m6A) is an abundant RNA epitranscriptomic modification in eukaryotes. The m6A machinery includes cellular writer, eraser and reader proteins that regulate m6A. Pteropus alecto (P. alecto) (the Australian black flying f...

  • Article
  • Open Access
1,977 Views
19 Pages

IMPI: An Interface for Low-Frequency Point Mutation Identification Exemplified on Resistance Mutations in Chronic Myeloid Leukemia

  • Julia Vetter,
  • Jonathan Burghofer,
  • Theodora Malli,
  • Anna M. Lin,
  • Gerald Webersinke,
  • Markus Wiederstein,
  • Stephan M. Winkler and
  • Susanne Schaller

Background: In genomics, highly sensitive point mutation detection is particularly relevant for cancer diagnosis and early relapse detection. Next-generation sequencing combined with unique molecular identifiers (UMIs) is known to improve the mutatio...

  • Review
  • Open Access
30 Citations
10,655 Views
38 Pages

16 December 2014

IMGT®, the international ImMunoGeneTics information system® (CNRS and Montpellier University) is the global reference in immunogenetics and immunoinformatics. By its creation in 1989, IMGT® marked the advent of immunoinformatics, which emerged at the...

  • Article
  • Open Access
9 Citations
4,405 Views
14 Pages

Docker4Circ: A Framework for the Reproducible Characterization of circRNAs from RNA-Seq Data

  • Giulio Ferrero,
  • Nicola Licheri,
  • Lucia Coscujuela Tarrero,
  • Carlo De Intinis,
  • Valentina Miano,
  • Raffaele Adolfo Calogero,
  • Francesca Cordero,
  • Michele De Bortoli and
  • Marco Beccuti

31 December 2019

Recent improvements in cost-effectiveness of high-throughput technologies has allowed RNA sequencing of total transcriptomes suitable for evaluating the expression and regulation of circRNAs, a relatively novel class of transcript isoforms with sugge...

  • Communication
  • Open Access
10 Citations
5,260 Views
6 Pages

Qiime2 is one of the most popular software tools used for analysis of output from metabarcoding experiments (e.g., sequencing of 16S, 18S, or ITS amplicons). Qiime2 introduced a novel and innovative data exchange format: the ‘Qiime2 artifact’. Qiime2...

  • Review
  • Open Access
68 Citations
11,568 Views
22 Pages

Modulating Composition and Metabolic Activity of the Gut Microbiota in IBD Patients

  • Mario Matijašić,
  • Tomislav Meštrović,
  • Mihaela Perić,
  • Hana Čipčić Paljetak,
  • Marina Panek,
  • Darija Vranešić Bender,
  • Dina Ljubas Kelečić,
  • Željko Krznarić and
  • Donatella Verbanac

The healthy intestine represents a remarkable interface where sterile host tissues come in contact with gut microbiota, in a balanced state of homeostasis. The imbalance of gut homeostasis is associated with the onset of many severe pathological cond...

  • Article
  • Open Access
13 Citations
5,595 Views
11 Pages

Using Personal Genomic Data within Primary Care: A Bioinformatics Approach to Pharmacogenomics

  • Rick Overkleeft,
  • Judith Tommel,
  • Andrea W. M. Evers,
  • Johan T. den Dunnen,
  • Marco Roos,
  • Marie-José Hoefmans,
  • Walter E. Schrader,
  • Jesse J. Swen,
  • Mattijs E. Numans and
  • Elisa J. F. Houwink

30 November 2020

One application of personalized medicine is the tailoring of medication to the individual, so that the medication will have the highest chance of success. In order to individualize medication, one must have a complete inventory of all current pharmac...

  • Article
  • Open Access
4 Citations
4,338 Views
20 Pages

Client Applications and Server-Side Docker for Management of RNASeq and/or VariantSeq Workflows and Pipelines of the GPRO Suite

  • Ahmed Ibrahem Hafez,
  • Beatriz Soriano,
  • Aya Allah Elsayed,
  • Ricardo Futami,
  • Raquel Ceprian,
  • Ricardo Ramos-Ruiz,
  • Genis Martinez,
  • Francisco Jose Roig,
  • Miguel Angel Torres-Font and
  • Carlos Llorens
  • + 8 authors

19 January 2023

The GPRO suite is an in-progress bioinformatic project for -omics data analysis. As part of the continued growth of this project, we introduce a client- and server-side solution for comparative transcriptomics and analysis of variants. The client-sid...

  • Article
  • Open Access
1 Citations
2,907 Views
23 Pages

5 February 2025

Electroencephalography (EEG) has existed since the early 20th century. It has proven to be a vital tool for electrophysiological studies of conditions like epilepsy. Recently, it has been revitalized as the field of machine learning has been developi...

  • Article
  • Open Access
9 Citations
6,407 Views
18 Pages

agReg-SNPdb: A Database of Regulatory SNPs for Agricultural Animal Species

  • Selina Klees,
  • Felix Heinrich,
  • Armin Otto Schmitt and
  • Mehmet Gültas

17 August 2021

Transcription factors (TFs) govern transcriptional gene regulation by specifically binding to short DNA motifs, known as transcription factor binding sites (TFBSs), in regulatory regions, such as promoters. Today, it is well known that single nucleot...

  • Article
  • Open Access
10 Citations
4,173 Views
14 Pages

Structure-Based Understanding of ABCA3 Variants

  • Marion Onnée,
  • Pascale Fanen,
  • Isabelle Callebaut and
  • Alix de Becdelièvre

24 September 2021

ABCA3 is a crucial protein of pulmonary surfactant biosynthesis, associated with recessive pulmonary disorders such as neonatal respiratory distress and interstitial lung disease. Mutations are mostly private, and accurate interpretation of variants...

  • Article
  • Open Access
59 Citations
8,365 Views
21 Pages

14 October 2019

The extracellular matrix (ECM) provides structural support for tissue architecture and is a major effector of cell behavior during skin repair and inflammation. Macrophages are involved in all stages of skin repair but only limited knowledge exists a...

  • Article
  • Open Access
1 Citations
3,030 Views
14 Pages

Unveiling CD59-Antibody Interactions to Design Paratope-Mimicking Peptides for Complement Modulation

  • Annamaria Sandomenico,
  • Alessia Ruggiero,
  • Emanuela Iaccarino,
  • Angela Oliver,
  • Flavia Squeglia,
  • Miguel Moreira,
  • Luciana Esposito,
  • Menotti Ruvo and
  • Rita Berisio

CD59 is an abundant immuno-regulatory human protein that protects cells from damage by inhibiting the complement system. CD59 inhibits the assembly of the Membrane Attack Complex (MAC), the bactericidal pore-forming toxin of the innate immune system....

  • Article
  • Open Access
612 Views
20 Pages

24 November 2025

The skin of vertebrates serves as a crucial interface with the external environment. In fish, it performs various functions, mainly offering protection against pathogens through the action of specialized cells. Cyclostomes, such as hagfish, lack scal...

  • Article
  • Open Access
3 Citations
3,155 Views
19 Pages

Iron Reduction in Dermacentor andersoni Tick Cells Inhibits Anaplasma marginale Replication

  • Muna Salem M. Solyman,
  • Jessica Ujczo,
  • Kelly A. Brayton,
  • Dana K. Shaw,
  • David A. Schneider and
  • Susan M. Noh

Anaplasma spp. are obligate intracellular, tick-borne, bacterial pathogens that cause bovine and human anaplasmosis. We lack tools to prevent these diseases in part due to major knowledge gaps in our fundamental understanding of the tick–pathog...

  • Article
  • Open Access
11 Citations
5,986 Views
19 Pages

Site Density Functional Theory and Structural Bioinformatics Analysis of the SARS-CoV Spike Protein and hACE2 Complex

  • Nitesh Kumawat,
  • Andrejs Tucs,
  • Soumen Bera,
  • Gennady N. Chuev,
  • Marat Valiev,
  • Marina V. Fedotova,
  • Sergey E. Kruchinin,
  • Koji Tsuda,
  • Adnan Sljoka and
  • Amit Chakraborty

26 January 2022

The entry of the SARS-CoV-2, a causative agent of COVID-19, into human host cells is mediated by the SARS-CoV-2 spike (S) glycoprotein, which critically depends on the formation of complexes involving the spike protein receptor-binding domain (RBD) a...

  • Article
  • Open Access
5 Citations
2,971 Views
12 Pages

5 September 2024

Virulencefactors (VFs) are key molecules that enable pathogens to evade the immune systems of the host. These factors are crucial for revealing the pathogenic processes of microbes and drug discovery. Identification of virulence factors in microbes b...

  • Article
  • Open Access
1 Citations
7,696 Views
16 Pages

The analysis of small RNA sequencing data across a range of biofluids is a significant research area, given the diversity of RNA types that hold potential diagnostic, prognostic, and predictive value. The intricate task of segregating the complex mix...

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