In silico design of targeted SRM-based experiments.

Abstract:

:Selected reaction monitoring (SRM)-based proteomics approaches enable highly sensitive and reproducible assays for profiling of thousands of peptides in one experiment. The development of such assays involves the determination of retention time, detectability and fragmentation properties of peptides, followed by an optimal selection of transitions. If those properties have to be identified experimentally, the assay development becomes a time-consuming task. We introduce a computational framework for the optimal selection of transitions for a given set of proteins based on their sequence information alone or in conjunction with already existing transition databases. The presented method enables the rapid and fully automated initial development of assays for targeted proteomics. We introduce the relevant methods, report and discuss a step-wise and generic protocol and we also show that we can reach an ad hoc coverage of 80 % of the targeted proteins. The presented algorithmic procedure is implemented in the open-source software package OpenMS/TOPP.

journal_name

BMC Bioinformatics

journal_title

BMC bioinformatics

authors

Nahnsen S,Kohlbacher O

doi

10.1186/1471-2105-13-S16-S8

subject

Has Abstract

pub_date

2012-01-01 00:00:00

pages

S8

issn

1471-2105

pii

1471-2105-13-S16-S8

journal_volume

13 Suppl 16

pub_type

杂志文章
  • A novel similarity-measure for the analysis of genetic data in complex phenotypes.

    abstract:BACKGROUND:Recent technological advances in DNA sequencing and genotyping have led to the accumulation of a remarkable quantity of data on genetic polymorphisms. However, the development of new statistical and computational tools for effective processing of these data has not been equally as fast. In particular, Machin...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-10-S6-S24

    authors: Lagani V,Montesanto A,Di Cianni F,Moreno V,Landi S,Conforti D,Rose G,Passarino G

    更新日期:2009-06-16 00:00:00

  • KRLMM: an adaptive genotype calling method for common and low frequency variants.

    abstract:BACKGROUND:SNP genotyping microarrays have revolutionized the study of complex disease. The current range of commercially available genotyping products contain extensive catalogues of low frequency and rare variants. Existing SNP calling algorithms have difficulty dealing with these low frequency variants, as the under...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-15-158

    authors: Liu R,Dai Z,Yeager M,Irizarry RA,Ritchie ME

    更新日期:2014-05-23 00:00:00

  • μHEM for identification of differentially expressed miRNAs using hypercuboid equivalence partition matrix.

    abstract:BACKGROUND:The miRNAs, a class of short approximately 22-nucleotide non-coding RNAs, often act post-transcriptionally to inhibit mRNA expression. In effect, they control gene expression by targeting mRNA. They also help in carrying out normal functioning of a cell as they play an important role in various cellular proc...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-14-266

    authors: Paul S,Maji P

    更新日期:2013-09-04 00:00:00

  • Prior knowledge guided eQTL mapping for identifying candidate genes.

    abstract:BACKGROUND:Expression quantitative trait loci (eQTL) mapping is often used to identify genetic loci and candidate genes correlated with traits. Although usually a group of genes affect complex traits, genes in most eQTL mapping methods are considered as independent. Recently, some eQTL mapping methods have accounted fo...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-016-1387-9

    authors: Wang Y,Richard R,Pan Y

    更新日期:2016-12-13 00:00:00

  • Robust structure measures of metabolic networks that predict prokaryotic optimal growth temperature.

    abstract:BACKGROUND:Metabolic networks reflect the relationships between metabolites (biomolecules) and the enzymes (proteins), and are of particular interest since they describe all chemical reactions of an organism. The metabolic networks are constructed from the genome sequence of an organism, and the graphs can be used to s...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-019-3112-y

    authors: Weber Zendrera A,Sokolovska N,Soula HA

    更新日期:2019-10-15 00:00:00

  • Hit integration for identifying optimal spaced seeds.

    abstract:BACKGROUND:Introduction of spaced speeds opened a way of sensitivity improvement in homology search without loss of search speed. Since then, the efforts of finding optimal seed which maximizes the sensitivity have been continued today. The sensitivity of a seed is generally computed by its hit probability. However, th...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-11-S1-S37

    authors: Chung WH,Park SB

    更新日期:2010-01-18 00:00:00

  • Blazing Signature Filter: a library for fast pairwise similarity comparisons.

    abstract:BACKGROUND:Identifying similarities between datasets is a fundamental task in data mining and has become an integral part of modern scientific investigation. Whether the task is to identify co-expressed genes in large-scale expression surveys or to predict combinations of gene knockouts which would elicit a similar phe...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-018-2210-6

    authors: Lee JY,Fujimoto GM,Wilson R,Wiley HS,Payne SH

    更新日期:2018-06-11 00:00:00

  • PubFocus: semantic MEDLINE/PubMed citations analytics through integration of controlled biomedical dictionaries and ranking algorithm.

    abstract:BACKGROUND:Understanding research activity within any given biomedical field is important. Search outputs generated by MEDLINE/PubMed are not well classified and require lengthy manual citation analysis. Automation of citation analytics can be very useful and timesaving for both novices and experts. RESULTS:PubFocus w...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-7-424

    authors: Plikus MV,Zhang Z,Chuong CM

    更新日期:2006-10-02 00:00:00

  • Towards integrative gene functional similarity measurement.

    abstract:BACKGROUND:In Gene Ontology, the "Molecular Function" (MF) categorization is a widely used knowledge framework for gene function comparison and prediction. Its structure and annotation provide a convenient way to compare gene functional similarities at the molecular level. The existing gene similarity measures, however...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-15-S2-S5

    authors: Peng J,Wang Y,Chen J

    更新日期:2014-01-01 00:00:00

  • Maximizing Kolmogorov Complexity for accurate and robust bright field cell segmentation.

    abstract:BACKGROUND:Analysis of cellular processes with microscopic bright field defocused imaging has the advantage of low phototoxicity and minimal sample preparation. However bright field images lack the contrast and nuclei reporting available with florescent approaches and therefore present a challenge to methods that segme...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-15-32

    authors: Mohamadlou H,Shope JC,Flann NS

    更新日期:2014-01-30 00:00:00

  • Exploring matrix factorization techniques for significant genes identification of Alzheimer's disease microarray gene expression data.

    abstract:BACKGROUND:The wide use of high-throughput DNA microarray technology provide an increasingly detailed view of human transcriptome from hundreds to thousands of genes. Although biomedical researchers typically design microarray experiments to explore specific biological contexts, the relationships between genes are hard...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-12-S5-S7

    authors: Kong W,Mou X,Hu X

    更新日期:2011-01-01 00:00:00

  • DeepCryoPicker: fully automated deep neural network for single protein particle picking in cryo-EM.

    abstract:BACKGROUND:Cryo-electron microscopy (Cryo-EM) is widely used in the determination of the three-dimensional (3D) structures of macromolecules. Particle picking from 2D micrographs remains a challenging early step in the Cryo-EM pipeline due to the diversity of particle shapes and the extremely low signal-to-noise ratio ...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-020-03809-7

    authors: Al-Azzawi A,Ouadou A,Max H,Duan Y,Tanner JJ,Cheng J

    更新日期:2020-11-09 00:00:00

  • CONSTAX: a tool for improved taxonomic resolution of environmental fungal ITS sequences.

    abstract:BACKGROUND:One of the most crucial steps in high-throughput sequence-based microbiome studies is the taxonomic assignment of sequences belonging to operational taxonomic units (OTUs). Without taxonomic classification, functional and biological information of microbial communities cannot be inferred or interpreted. The ...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-017-1952-x

    authors: Gdanetz K,Benucci GMN,Vande Pol N,Bonito G

    更新日期:2017-12-06 00:00:00

  • An algorithm for automated closure during assembly.

    abstract:BACKGROUND:Finishing is the process of improving the quality and utility of draft genome sequences generated by shotgun sequencing and computational assembly. Finishing can involve targeted sequencing. Finishing reads may be incorporated by manual or automated means. One automated method uses targeted addition by local...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-11-457

    authors: Koren S,Miller JR,Walenz BP,Sutton G

    更新日期:2010-09-10 00:00:00

  • Uncovering packaging features of co-regulated modules based on human protein interaction and transcriptional regulatory networks.

    abstract:BACKGROUND:Network co-regulated modules are believed to have the functionality of packaging multiple biological entities, and can thus be assumed to coordinate many biological functions in their network neighbouring regions. RESULTS:Here, we weighted edges of a human protein interaction network and a transcriptional r...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-11-392

    authors: Chen L,Wang H,Zhang L,Li W,Wang Q,Shang Y,He Y,He W,Li X,Tai J,Li X

    更新日期:2010-07-22 00:00:00

  • Bounded search for de novo identification of degenerate cis-regulatory elements.

    abstract:BACKGROUND:The identification of statistically overrepresented sequences in the upstream regions of coregulated genes should theoretically permit the identification of potential cis-regulatory elements. However, in practice many cis-regulatory elements are highly degenerate, precluding the use of an exhaustive word-cou...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-7-254

    authors: Carlson JM,Chakravarty A,Khetani RS,Gross RH

    更新日期:2006-05-15 00:00:00

  • MeDEStrand: an improved method to infer genome-wide absolute methylation levels from DNA enrichment data.

    abstract:BACKGROUND:DNA methylation of CpG dinucleotides is an essential epigenetic modification that plays a key role in transcription. Widely used DNA enrichment-based methods offer high coverage for measuring methylated CpG dinucleotides, with the lowest cost per CpG covered genome-wide. However, these methods measure the DN...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-018-2574-7

    authors: Xu J,Liu S,Yin P,Bulun S,Dai Y

    更新日期:2018-12-22 00:00:00

  • Frnakenstein: multiple target inverse RNA folding.

    abstract:BACKGROUND:RNA secondary structure prediction, or folding, is a classic problem in bioinformatics: given a sequence of nucleotides, the aim is to predict the base pairs formed in its three dimensional conformation. The inverse problem of designing a sequence folding into a particular target structure has only more rece...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-13-260

    authors: Lyngsø RB,Anderson JW,Sizikova E,Badugu A,Hyland T,Hein J

    更新日期:2012-10-09 00:00:00

  • MTAP: the motif tool assessment platform.

    abstract:BACKGROUND:In recent years, substantial effort has been applied to de novo regulatory motif discovery. At this time, more than 150 software tools exist to detect regulatory binding sites given a set of genomic sequences. As the number of software packages increases, it becomes more important to identify the tools with ...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-9-S9-S6

    authors: Quest D,Dempsey K,Shafiullah M,Bastola D,Ali H

    更新日期:2008-08-12 00:00:00

  • Roar: detecting alternative polyadenylation with standard mRNA sequencing libraries.

    abstract:BACKGROUND:Post-transcriptional regulation is a complex mechanism that plays a central role in defining multiple cellular identities starting from a common genome. Modifications in the length of 3'UTRs have been found to play an important role in this context, since alternative 3' UTRs could lead to differences for exa...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-016-1254-8

    authors: Grassi E,Mariella E,Lembo A,Molineris I,Provero P

    更新日期:2016-10-18 00:00:00

  • Clustering analysis of tumor metabolic networks.

    abstract:BACKGROUND:Biological networks are representative of the diverse molecular interactions that occur within cells. Some of the commonly studied biological networks are modeled through protein-protein interactions, gene regulatory, and metabolic pathways. Among these, metabolic networks are probably the most studied, as t...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-020-03564-9

    authors: Manipur I,Granata I,Maddalena L,Guarracino MR

    更新日期:2020-08-21 00:00:00

  • Detection of biological switches using the method of Gröebner bases.

    abstract:BACKGROUND:Bistability and ability to switch between two stable states is the hallmark of cellular responses. Cellular signaling pathways often contain bistable switches that regulate the transmission of the extracellular information to the nucleus where important biological functions are executed. RESULTS:In this wor...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-019-3155-0

    authors: Arkun Y

    更新日期:2019-11-28 00:00:00

  • Generating confidence intervals on biological networks.

    abstract:BACKGROUND:In the analysis of networks we frequently require the statistical significance of some network statistic, such as measures of similarity for the properties of interacting nodes. The structure of the network may introduce dependencies among the nodes and it will in general be necessary to account for these de...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-8-467

    authors: Thorne T,Stumpf MP

    更新日期:2007-11-30 00:00:00

  • SDA: a semi-parametric differential abundance analysis method for metabolomics and proteomics data.

    abstract:BACKGROUND:Identifying differentially abundant features between different experimental groups is a common goal for many metabolomics and proteomics studies. However, analyzing data from mass spectrometry (MS) is difficult because the data may not be normally distributed and there is often a large fraction of zero value...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/s12859-019-3067-z

    authors: Li Y,Fan TWM,Lane AN,Kang WY,Arnold SM,Stromberg AJ,Wang C,Chen L

    更新日期:2019-10-17 00:00:00

  • Structural characterization of genomes by large scale sequence-structure threading: application of reliability analysis in structural genomics.

    abstract:BACKGROUND:We establish that the occurrence of protein folds among genomes can be accurately described with a Weibull function. Systems which exhibit Weibull character can be interpreted with reliability theory commonly used in engineering analysis. For instance, Weibull distributions are widely used in reliability, ma...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-5-101

    authors: Cherkasov A,Ho Sui SJ,Brunham RC,Jones SJ

    更新日期:2004-07-26 00:00:00

  • Taking U out, with two nucleases?

    abstract:BACKGROUND:REX1 and REX2 are protein components of the RNA editing complex (the editosome) and function as exouridylylases. The exact roles of REX1 and REX2 in the editosome are unclear and the consequences of the presence of two related proteins are not fully understood. Here, a variety of computational studies were p...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-7-305

    authors: Mian IS,Worthey EA,Salavati R

    更新日期:2006-06-16 00:00:00

  • Low degree metabolites explain essential reactions and enhance modularity in biological networks.

    abstract:BACKGROUND:Recently there has been a lot of interest in identifying modules at the level of genetic and metabolic networks of organisms, as well as in identifying single genes and reactions that are essential for the organism. A goal of computational and systems biology is to go beyond identification towards an explana...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-7-118

    authors: Samal A,Singh S,Giri V,Krishna S,Raghuram N,Jain S

    更新日期:2006-03-08 00:00:00

  • Identifying cancer mutation targets across thousands of samples: MuteProc, a high throughput mutation analysis pipeline.

    abstract:BACKGROUND:In the past decade, bioinformatics tools have matured enough to reliably perform sophisticated primary data analysis on Next Generation Sequencing (NGS) data, such as mapping, assemblies and variant calling, however, there is still a dire need for improvements in the higher level analysis such as NGS data or...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-14-167

    authors: Hadj Khodabakhshi A,Fejes AP,Birol I,Jones SJ

    更新日期:2013-05-28 00:00:00

  • Fast max-margin clustering for unsupervised word sense disambiguation in biomedical texts.

    abstract:BACKGROUND:We aim to solve the problem of determining word senses for ambiguous biomedical terms with minimal human effort. METHODS:We build a fully automated system for Word Sense Disambiguation by designing a system that does not require manually-constructed external resources or manually-labeled training examples e...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-10-S3-S4

    authors: Duan W,Song M,Yates A

    更新日期:2009-03-19 00:00:00

  • Domain fusion analysis by applying relational algebra to protein sequence and domain databases.

    abstract:BACKGROUND:Domain fusion analysis is a useful method to predict functionally linked proteins that may be involved in direct protein-protein interactions or in the same metabolic or signaling pathway. As separate domain databases like BLOCKS, PROSITE, Pfam, SMART, PRINTS-S, ProDom, TIGRFAMs, and amalgamated domain datab...

    journal_title:BMC bioinformatics

    pub_type: 杂志文章

    doi:10.1186/1471-2105-4-16

    authors: Truong K,Ikura M

    更新日期:2003-05-06 00:00:00