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1.
Nucleic Acids Res ; 37(Web Server issue): W575-80, 2009 Jul.
Artículo en Inglés | MEDLINE | ID: mdl-19465378

RESUMEN

RHYTHM is a web server that predicts buried versus exposed residues of helical membrane proteins. Starting from a given protein sequence, secondary and tertiary structure information is calculated by RHYTHM within only a few seconds. The prediction applies structural information from a growing data base of precalculated packing files and evolutionary information from sequence patterns conserved in a representative dataset of membrane proteins ('Pfam-domains'). The program uses two types of position specific matrices to account for the different geometries of packing in channels and transporters ('channels') or other membrane proteins ('membrane-coils'). The output provides information on the secondary structure and topology of the protein and specifically on the contact type of each residue and its conservation. This information can be downloaded as a graphical file for illustration, a text file for analysis and statistics and a PyMOL file for modeling purposes. The server can be freely accessed at: URL: http://proteinformatics.de/rhythm.


Asunto(s)
Proteínas de la Membrana/química , Proteínas de Transporte de Membrana/química , Programas Informáticos , Modelos Moleculares , Estructura Secundaria de Proteína , Estructura Terciaria de Proteína , Reproducibilidad de los Resultados
2.
F1000Res ; 72018.
Artículo en Inglés | MEDLINE | ID: mdl-31543945

RESUMEN

Software Containers are changing the way scientists and researchers develop, deploy and exchange scientific software. They allow labs of all sizes to easily install bioinformatics software, maintain multiple versions of the same software and combine tools into powerful analysis pipelines. However, containers and software packages should be produced under certain rules and standards in order to be reusable, compatible and easy to integrate into pipelines and analysis workflows. Here, we presented a set of recommendations developed by the BioContainers Community to produce standardized bioinformatics packages and containers. These recommendations provide practical guidelines to make bioinformatics software more discoverable, reusable and transparent.  They are aimed to guide developers, organisations, journals and funders to increase the quality and sustainability of research software.


Asunto(s)
Biología Computacional , Programas Informáticos , Humanos , Investigadores , Flujo de Trabajo
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