Standards-based metadata management for molecular simulations

Concurrency and Computation: Practice and Experience

Volumn 26, Issue 10, 2014, Pages 1744-1759

  Grunzke, Richard ^a   Breuers, Sebastian ^b   Gesing, Sandra ^c   Herres Pawlis, Sonja ^d   Kruse, Martin ^e   Blunk, Dirk ^b   De La Garza, Luis ^f   Packschies, Lars ^b   Schäfer, Patrick ^b   Schärfe, Charlotta ^f   Schlemmer, Tobias ^a   Steinke, Thomas ^g   Schuller, Bernd ^h   Müller Pfefferkorn, Ralph ^a   Jäkel, René ^a   Nagel, Wolfgang E ^a   Atkinson, Malcolm ^c   Krüger, Jens ^f  

^a DRESDEN UNIVERSITY OF TECHNOLOGY   (Germany)

^b UNIVERSITY OF COLOGNE   (Germany)

^c UNIVERSITY OF EDINBURGH   (United Kingdom)

^d UNIVERSITY OF MUNICH   (Germany)

^e PRODYNA AG   (Germany)

^f UNIVERSITY OF TÜBINGEN   (Germany)

^g ZUSE INSTITUTE BERLIN   (Germany)

^h FORSCHUNGSZENTRUM JÜLICH   (Germany)

Author keywords

metadata management; molecular simulations; MSML; science gateway

Indexed keywords

MARKUP LANGUAGES; METADATA; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; PROTEINS; QUANTUM CHEMISTRY; SEMANTICS;

CHEMICAL MARKUP LANGUAGES; COMPUTATIONAL ASPECTS; HIGH PERFORMANCE COMPUTING; METADATA MANAGEMENT; MOLECULAR SIMULATIONS; MSML; SCIENCE GATEWAY; STATE OF THE ART;

COMPUTATIONAL CHEMISTRY;

EID: 84902545391     PISSN: 15320626     EISSN: 15320634     Source Type: Journal    
DOI: 10.1002/cpe.3116     Document Type: Conference Paper

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