MolSSI
  • People
    • Board of Directors
    • Science & Software Advisory Board
    • MolSSI Software Scientists
    • MolSSI Associates
  • Fellowships
    • The MolSSI Software Fellowship Program
    • All MolSSI Software Fellows
    • 2021-A Seed Software Fellows
    • 2020-B and COVID-19 Seed Software Fellows
    • 2020-B Investment Software Fellows
    • 2020-A Seed Software Fellows
    • 2020-A Investment Software Fellows
  • Workshops
    • MolSSI Workshops: Full Listing
    • 2020
      • Open Source Software for Rare-Event Sampling Strategies
      • MolSSI/BioExcel Workshop on Workflows in Biomolecular Simulations
      • Biennial Conference on Chemical Education (BCCE)
      • MolSSI Driver Interface (MDI)
    • 2019
      • Stochastic Approaches to Electronic Structure Calculations
      • Software for Advanced Potential Energy Surfaces
      • Summer School and Workshop on Parallel Computing in Molecular Sciences
      • The Open Molecular Science Cloud
      • Molecular Dynamics Software Interoperability
      • Rovibrational Molecular Spectroscopy
      • Machine Learning and Chemistry: Challenges on the Way Forward
      • A Science Gateway for Atomic and Molecular Physics
    • 2018
      • Science Gateways Community Institute
      • NSF SSE/SSI PIs Workshop
      • Modular Software Infrastructure for Excited State Dynamics
      • Tinker Modeling Software
      • Python for Quantum Chemistry and Materials Simulation
      • Solving or Circumventing Eigenvalue Problems in Electronic Structure Theory
      • Summer School and Workshop Parallel Computing in Molecular Sciences
      • Workflows in Biomolecular Simulations
    • 2017
      • Computational Materials Science
      • Biomolecular Simulation
      • Core Software Blocks in Quantum Chemistry
      • Interoperability
      • Excited States
      • Coding Solvation
      • Best Practices in Molecular Simulation
      • Biomolecular Workflows
      • Quantum Mechanics Schema
    • 2016
      • Cyberinfrastructure and the Molecular Sciences
  • Education
    • MolSSI Education Resources
    • MolSSI Best Practices
    • Summer Schools
    • Coding Workshop @ MERCURY
  • News & Events
  • Software
    • Software Projects
    • COVID-19 Hub
    • MolSSI@Github
    • Basis Set Exchange
    • MolSSI Integral Reference Project
    • QCArchive
    • QCSchema
    • MolSSI Driver Interface
    • CMS Cookiecutter
  • Resources
    • Frequently Asked Questions (FAQs)
    • Publications from the MolSSI
    • Community Code Database
    • MolSSI Community Code Partners
    • Job Opportunities in the Molecular Sciences
    • Requesting a Letter of Collaboration
  • Subscribe
MolSSI Coding Workshop @ MERCURY

MolSSI Coding Workshop @ MERCURY

For the last several years, the MolSSI has hosted a coding workshop at the each MERCURY Consortium conference at Furman University.  This workshop offers up to 50 undergraduate conference attendees an opportunity to learn the fundamentals of running and analyzing molecular dynamics simulations and quantum chemical calculations with various community codes using Python scripting, Jupyter notebooks, and GitHub repositories for software development.

Details on the 2019 MolSSI Coding Workshop @ MERCURY is here.

Upcoming Events

  • 2021 MolSSI Interoperability Workshop at ONLINE

    In 2017, the MolSSI held an Interoperability Workshop during which we asked the community to clarify current needs for interoperability among computational molecular sciences (CMS) codes.  We have spent the

    June 14, 2021 – June 16, 2021
View All Events



Contact Us

E: info@molssi.org
P: (540) 231-4457
Location: 1880 Pratt Drive, Suite 1100
Blacksburg, VA 24060

Subscribe to our mailing list

Board of Directors

T. Daniel Crawford (Virginia Tech)
Cecilia Clementi (Rice University)
Robert Harrison (Stony Brook University)
Teresa Head-Gordon (U.C. Berkeley)
Shantenu Jha (Rutgers University)
Anna Krylov (U. Southern California)
Theresa Windus (Iowa State University)
Dominika Zgid (U. Michigan)

Connect with us

Visit Us On FacebookVisit Us On LinkedinVisit Us On Twitter

NSFLogoThe MolSSI is supported by the U.S. National Science Foundation through grant number OAC-1547580.

© 2020 The Molecular Sciences Software Institute, Designed by FourDesign
Close Window

Loading, Please Wait!

This may take a second or two. Loading, Please Wait!