Name: Extended Software Development Workshop: Scaling Electronic Structure Applications
Start: 2019-01-07T00:00:00+01:00
End: 2019-01-18T23:59:59+01:00
Location: CECAM-IRL Node

RT @Luke_Drury: Indeed. Industrial training and induction to HPC is a strength of both @ichec and @ECAM2020 https://t.co/7T0l2qneyO8 days ago
Module of the Month: QQ-Interface (Quantics-QChem-Interface) https://t.co/JuTqpSWK7I @QChemSoftware https://t.co/2g21l2opHD11 days ago
New @ECAM2020 publication is out: "Unimolecular FRET Sensors: Simple Linker Designs and Properties"… https://t.co/Se9Ivdj8FC32 days ago
RT @jchodera: David Swenson @davidswenson is talking about Open Path Sampling! https://t.co/QuBlI5P9aE Follow @pathsampling for all the lat…43 days ago
Module of the Month: PLUMED wrapper for OpenPathSampling. https://t.co/bQc3xkL1CN @pathsampling @plumed_org https://t.co/ofBi6JGZae43 days ago
E-CAM newsletter is out: https://t.co/laFLtqKgS8 … Subscribe to our next issues here: https://t.co/KhkOralKkE #H2020 https://t.co/0usRbOAF0f51 days ago

QQ-Interface (Quantics-QChem-Interface)
December 3, 2018
The QQ-Interface module connects the full quantum nonadiabatic wavefunction propagation code …
New publication is out: “Unimolecular FRET Sensors: Simple Linker Designs and Properties”
November 12, 2018
A new publication by researchers at University College Dublin …
PLUMED wrapper for OpenPathSampling
November 1, 2018
PLUMED is a widely used and versatile rare-event sampling …
The Curse of Dimensionality in Data-Intensive Modeling in Medicine, Biology, and Diagnostics
October 23, 2018
With Prof. Tim Conrad (TC), Free University of Berlin, and …

E-CAM

A path to extreme-scale computing for industry and academia

Keep up to date with the latest news from E-CAM

E-CAM Survey of Application Software

European Centre of Excellence

Supporting HPC simulations in industry and academia through software development, training and discussion in simulation and modeling

Attend an event

Access our software repository

Ask a technical question

Become a partner

E-CAM's stories

Interviews, opinion pieces, success stories, case studies.

The Curse of Dimensionality in Data-Intensive Modeling in Medicine, Biology, and Diagnostics

E-CAM Case Study: Designing control pulses for superconducting qubit systems with local control theory

E-CAM Case Study: The implementation of a hierarchical equilibration strategy for polymer melts, to help studying the rheological properties of new composite materials

The simulation of metal ions in protein-water systems using machine learning: An E-CAM case study and conversation

View All Stories

Modules of the month

What is a module?

December

QQ-Interface (Quantics-QChem-Interface)

View All Modules of the Month

Upcoming E-CAM events

Extended Software Development Workshop: Scaling Electronic Structure Applications

Recent Posts

QQ-Interface (Quantics-QChem-Interface)

New publication is out: “Unimolecular FRET Sensors: Simple Linker Designs and Properties”

PLUMED wrapper for OpenPathSampling

The Curse of Dimensionality in Data-Intensive Modeling in Medicine, Biology, and Diagnostics

View All Posts

Get the latest news from E-CAM

Sign up for our quarterly newsletter