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METAGUI. A VMD interface for analyzing metadynamics and molecular dynamics simulations

Publications associées (40)

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Atomistic model structure of the Ge(100)-GeO2 interface

Alfredo Pasquarello, Peter Broqvist, Jan Felix Binder

An atomistic model of the Ge-GeO2 interface has been generated through first-principle methods based on density functional theory. The interface model consists of amorphous GeO2 connected to crystalline Ge through a substoichiometric oxide region showing r ...

2009

The AMIDA Automatic Content Linking Device: Just-in-Time Document Retrieval in Meetings

Andrei Popescu-Belis

The AMIDA Automatic Content Linking Device (ACLD) is a just-in-time document retrieval system for meeting environments. The ACLD listens to a meeting and displays information about the documents from the group’s history that are most relevant to what is be ...

Springer-Verlag2008

A User Interface for Mobile Robotized Tele-echography

Nikolaos Thomos

Ultrasound imaging allows the evaluation of the degree of emergency of a patient. However, in many situations no experienced sonographer is available to perform such echography. To cope with this issue, the OTELO project “mObile Tele-Echography using an ul ...

Elsevier2006

A middleware for fast and flexible sensor network deployment

Karl Aberer, Manfred Hauswirth, Ali Salehi

A key problem in current sensor network technology is the heterogeneity of the available software and hardware platforms which makes deployment and application development a tedious and time consuming task. To minimize the unnecessary and repetitive implem ...

2006

Abrupt model interface for the 4H(1000)SiC-SiO2 interface

Alfredo Pasquarello, Fabien Devynck

Through the sequential use of classical molecular dynamics and first-principles relaxation methods, we generate an abrupt model interface for the 4H(0001)SiC-SiO2 interface showing regular structural parameters without any coordination defect. The bond den ...

2005

Bridging Ethnography and Engineering through the Graphical Language of Petri Nets

Both ethnographers and engineers deal with contextual and situational complexity in human behavior. For engineers, this complexity creates challenges in designing systems to support humans that are useful and predictable across a wide range of contexts bec ...

2005

SVG for SCADA Applications

Esther Gelle

In this paper, we study the applicability of SVG to SCADA (Supervisory Control and Data Acquisition) systems. One of the main purposes of a SCADA application is to provide an operator with the graphical interface needed to monitor and control the productio ...

2004

Virtual classroom for multimedia teaching on WWW

Pierre Vandergheynst, Murat Kunt, Iva Bogdanova Vandergheynst

The specific issue addressed in this paper is tailoring specific functionality to allow a group of teachers and students to carry out the learning process in Digital Signal and Image Processing in an electronic virtual environment that is meant to replace ...

EUSIPCO2002

B-Spline Snakes and a JAVA Interface: An Intuitive Tool for General Contour Delineation

Michaël Unser

We present a novel formulation for B-spline snakes that can be used as a tool for fast and intuitive contour outlining. The theory is implemented in a platform independent JAVA interface, which allows real time computation of the snake curve. In this paper ...

IEEE1998

Distributed run-time visualization and solution steering of parallel flow simulations

Mark Sawley

A run-time visualization and solution-steering tool, TPview, has been developed to overcome difficulties commonly encountered with large-scale numerical simulations on high-performance parallel computer systems. TPview provides the interface between the pa ...

1998