Advanced School of Molecular Simulation
October 16th to 18th, 2023. Campinas, Brazil Institute of Chemistry – University of Campinas (UNICAMP) Lecturer Prof. Wilfred van Gunsteren, ETHZ, Switzerland www.igc.ethz.ch and www.gromos.net
Author : cces cces
Post-Doctoral position: Dynamics and reaction mechanisms of carbohydrate-active enzymes
The Center for Computing in Engineering and Sciences (CCES) at the State University of São Paulo (UNICAMP) in Brazil seeks to fill two post-doctoral positions in the
Post-Doctoral position: Molecular Modeling of Protein-Solvent interactions
The Center for Computing in Engineering and Sciences (CCES) at the State University of Campinas (UNICAMP) in Brazil is seeking to fill a post-doctoral position
MassCCS: A high performance collision cross sections software for macro- molecules
CCES INTERNATIONAL WORKSHOP 2022 Dez 6, 2022 Samuel Cajahuaringa In this work, we present MassCCS, a parallelized open-source code for computing
Fault Tolerance in OpenMP Target Applications
Dez 6, 2022 CCES INTERNATIONAL WORKSHOP 2022 Pedro Henrique Di Francia Rosso With the growth of High Performance Computing (HPC) systems usage,
Sharing COVID-19 Data: Open Science and the FAPESP COVID-19 Data Repository
Oct 19, 2020 Keynote – CLEI LatinAmerican Conference in Informatics 2020 Claudia Bauzer Medeiros The Open Science movement is spreading all over
MassCCS: Massive Collision Cross Section calculations for large macromolecular assemblies
This repository contains a set of source codes and input scripts that allows to perform nonequilibrium f MassCCS is an efficient parallel software for calculating
Scientific Dissemination: The CCES website
We are excited to share with you one of our most significant initiatives – the creation of the CCES website! The website, located at http://cces.unicamp.br,
Selecting efficient VM types to train deep learning models on Amazon SageMaker
The cloud has become a popular environment for running Deep Learning (DL) applications. Public cloud providers charge by the amount of time the resources are
The OpenMP Cluster Programming Model
Despite the various research initiatives and proposed programming models, efficient solutions for parallel programming in HPC clusters still rely on a complex combination of different
Improving Phased Transactional Memory via Commit Throughput and Capacity Estimation
Transactional Memory (TM) is a programming abstraction that aims to ease parallel programming in shared-memory architectures. Both Hardware (HTM) and Software Transactional Memory (STM) implementations
Using Barrier Elision to Improve Transactional Code Generation
With chip manufacturers such as Intel, IBM, and ARM offering native support for transactional memory in their instruction set architectures, memory transactions are on the