Search bioRxivSearch

bioRxiv · 10.1101/408666

HPCI: A Perl module for writing cluster-portable bioinformatics pipelines

Abstract

BackgroundMost biocomputing pipelines are run on clusters of computers. Each type of cluster has its own API (application programming interface). That API defines how a program that is to run on the cluster must request the submission, content and monitoring of jobs to be run on the cluster. Sometimes, it is desirable to run the same pipeline on different types of cluster. This can happen in situations including when:\n\nO_LIdifferent labs are collaborating, but they do not use the same type of cluster\nC_LIO_LIa pipeline is released to other labs as open source or commercial software\nC_LIO_LIa lab has access to multiple types of cluster, and wants to choose between them for scaling, cost or other purposes\nC_LIO_LIa lab is migrating their infrastructure from one cluster type to another\nC_LIO_LIduring testing or travelling, it is often desired to run on a single computer\nC_LI\n\nHowever, since each type of cluster has its own API, code that runs jobs on one type of cluster needs to be re-written if it is desired to run that application on a different type of cluster. To resolve this problem, we created a software module to generalize the submission of pipelines across computing environments, including local compute, clouds and clusters.\n\nResultsHPCI (High Performance Computing Interface) is a Perl module that provides the interface to a standardized generic cluster.\n\nWhen the HPCI module is used, it accepts a parameter to specify the cluster type. The HPCI module uses this to load a driver HPCD:: . This is used to translate the abstract HPCI interface to the specific software interface.\n\nSimply by changing the cluster parameter, the same pipeline can be run on a different type of cluster with no other changes.\n\nConclusionThe HPCI module assists in writing Perl programs that can be run in different lab environments, with different site configuration requirements and different types of hardware clusters. Rather than having to re-write portions of the program, it is only necessary to change a configuration file.\n\nUsing HPCI, an application can manage collections of jobs to be runs, specify ordering dependencies, detect success or failure of jobs run and allow automatic retry of failed jobs (allowing for the possibility of a changed configuration such as when the original attempt specified an inadequate memory allotment).

Explore related subjects

Keep this discovery

BibTeXRIS

Macdonald, J. M., Lalansingh, C. M., Cooper, C. I., Yang, A., Lam, F., Boutros, P. C.. 2018-09-05. HPCI: A Perl module for writing cluster-portable bioinformatics pipelines. https://doi.org/10.1101/408666

Cite the original work for its findings. Save a collection to share your selection of sources.

KEEP EXPLORING

Related preprints

spatialMET: an open and scalable framework for spatial metabolomics analysis

Mass spectrometry imaging (MSI) enables spatially resolved metabolomics in intact tissue sections, but analysis remains challenging at scale. Existing MSI workflows often require users to combine multiple software tools, while others rely on proprietary vendor software that limits interoperability and reproducibility. To address these challenges, we developed spatialMET, an open-source framework that provides an end-to-end workflow for MSI analysis. spatialMET provides a unified platform for preprocessing, spatial domain detection, and visualization. Downstream analyses include differential abundance testing, spatial autocorrelation and gradient analysis, dimensionality reduction, and correlation network analysis. Spatial domain detection uses hcdist, a C-based hierarchical clustering implementation that substantially reduces runtime and memory use relative to existing R-based approaches. spatialMET can be run through an interactive R Shiny application or as a standalone command-line workflow for larger datasets or high-performance computing environments. Applied to mouse small cell lung cancer MALDI-MSI data containing 284,673 pixels, spatialMET identified tumor-associated, stromal, and adjacent lung spatial domains that aligned with matched histology. Differential abundance analysis identified 117 m/z features that differed between tumor and stromal regions, while spatial autocorrelation analyses revealed spatially structured abundance patterns. Applying spatialMET to mouse lung adenocarcinoma data from an entire lung lobe containing 338,477 pixels further demonstrated scalability and captured spatial heterogeneity across tumor and surrounding lung tissue. In summary, spatialMET provides a scalable, open-source framework for end-to-end spatial metabolomics analysis, and it is distributed as a Docker container for reproducible deployment. Source code and installation instructions are available at https://github.com/biodatalab/spatialMET.

bioinformatics

Probing the transcriptome response to shivering in skeletal muscle using a multilayered bioinformatics approach

Cold acclimation holds therapeutic potential for improving metabolic health. We previously demonstrated that repeated cold-induced shivering enhances insulin sensitivity in humans. However, the molecular pathways that underlie the skeletal muscle shivering response, and how these relate to beneficial physiological effects, remain poorly understood. In this study, we combined complementary bioinformatics approaches to allow in-depth analysis of the transcriptomic response of human skeletal muscle to repeated shivering. We identified a robust transcriptional signature and show a sex-specific component in the shivering skeletal muscle response, which seemed to diminish following cold adaptation. Our findings provide mechanistic insights into cold-induced muscle adaptations, shed light on potential interesting molecular targets for further investigation, and emphasize the importance of including both sexes in future cold acclimation studies.

bioinformatics

An Information Geometry approach to model topological trajectories and Gene Expression Radius from UMAP geometry.

Understanding the relationship between gene expression dynamics and cellular identity remains a central challenge in single cell biology. Here, we introduce a novel computational and mathematical framework that integrates information geometry, fuzzy topology, and UMAP analysis to model gene expression landscapes derived from single cell RNA sequencing data. We formalize gene expression data as a fuzzy topological space, where interactions between expression points are governed by probabilistic distributions inspired by manifold learning approaches such as UMAP. Within this framework, we define an information geometric structure through a Fisher metric induced by these distributions, enabling the computation of geodesic trajectories that capture cellular differentiation processes. A key contribution of this work is the derivation of analytical conditions, expressed as expression radius formulas, that characterize local neighborhoods in gene expression space. These conditions allow for the identification of genes associated with stem cell states and predictions in transitional cell types in future work. Application of the proposed framework to single cell datasets reveals biologically meaningful gene sets enriched in key regulatory pathways and transcription factors, demonstrating the capacity of our approach to uncover latent structure in complex gene expression data. Our results suggest that integrating differential geometry with statistical learning theory offers a powerful paradigm for modeling genotype and phenotype relationships and cellular state transitions, with potential implications for precision medicine and systems biology.

bioinformatics