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Concept

Workflow

Publications associées (29)

A computational workflow for the expansion of heterologous biosynthetic pathways to natural product derivatives

Vassily Hatzimanikatis, Jasmin Maria Hafner

Plant natural products (PNPs) and their derivatives are important but underexplored sources of pharmaceutical molecules. To access this untapped potential, the reconstitution of heterologous PNP biosynthesis pathways in engineered microbes provides a valua ...

Nature Research2021

Designing Multi-disciplinary Interactive Virtual Environments for Next-Generation Immersive Learning Experiences: Case Studies and Future Directions in Astrobiology, Anatomy and Cultural Heritage

Sarah Irene Brutton Kenderdine

This chapter describes the creation and deployment of the Immersive Learning Level Editor (iLLE), a new cross-platform IVE engineered at the University of New South Wales (UNSW) Sydney. It illustrates the design considerations, discipline-specific workflow ...

Springer, Cham2021

A performance-driven simulation workflow for PV integration into the design process: application on an innovative building project in Switzerland

Sergi Aguacil Moreno

In the construction sector, the integration of active elements functioning both as building envelope material and on-site electricity generator is identified as a key measure to achieve the 2050 targets and carbon neutrality (Aguacil Moreno, 2019; Aguacil ...

2021

Workflow Engineering in Materials Design within the BATTERY 2030+Project

Giovanni Pizzi, Leonid Kahle, Sebastiaan Philippe Huber

In recent years, modeling and simulation of materials have become indispensable to complement experiments in materials design. High-throughput simulations increasingly aid researchers in selecting the most promising materials for experimental studies or by ...

WILEY-V C H VERLAG GMBH2021

The effects of model complexity and size on metabolic flux distribution and control: case study in Escherichia coli

Vassily Hatzimanikatis, Georgios Fengos, Tuure Eelis Hameri

Background Significant efforts have been made in building large-scale kinetic models of cellular metabolism in the past two decades. However, most kinetic models published to date, remain focused around central carbon pathways or are built around ad hoc re ...

BMC2021

SLITRONOMY: Towards a fully wavelet-based strong lensing inversion technique

Frédéric Courbin, Aymeric Alexandre Galan, Austin Chandler Peel, Rémy Elie Joseph

Strong gravitational lensing provides a wealth of astrophysical information on the baryonic and dark matter content of galaxies. It also serves as a valuable cosmological probe by allowing us to measure the Hubble constant independently of other methods. T ...

EDP SCIENCES S A2021

AiiDA 1.0, a scalable computational infrastructure for automated reproducible workflows and data provenance

Nicola Marzari, Giovanni Pizzi, Christoph Leopold Talirz, Nicolas Frank Mounet, Andrea Cepellotti, Leonid Kahle, Fernando Gargiulo, Martin Uhrin, Sebastiaan Philippe Huber, Aliaksandr Yakutovich, Snehal Pramod Kumbhar, Carl Simon Adorf, Francisco Fernando Ramirez, Casper Welzel Andersen, Conrad Johnston, Spyros Zoupanos, Elsa Passaro

The ever-growing availability of computing power and the sustained development of advanced computational methods have contributed much to recent scientific progress. These developments present new challenges driven by the sheer amount of calculations and d ...

2020

Workflows in AiiDA: Engineering a high-throughput, event-based engine for robust and modular computational workflows

Nicola Marzari, Giovanni Pizzi, Martin Uhrin, Sebastiaan Philippe Huber

Over the last two decades, the field of computational science has seen a dramatic shift towards incorporating high-throughput computation and big-data analysis as fundamental pillars of the scientific discovery process. This has necessitated the developmen ...

2020

Artificial Intelligence in Musculoskeletal Imaging: Review of Current Literature, Challenges, and Trends

Tobias Kober, Jonas Richiardi

Artificial intelligence (AI) has gained major attention with a rapid increase in the number of published articles, mostly recently. This review provides a general understanding of how AI can or will be useful to the musculoskeletal radiologist. After a bri ...

THIEME MEDICAL PUBL INC2019