The Molecular Sciences Software Institute serves as a nexus for science, education, and cooperation serving the worldwide community of computational molecular scientists – a broad field including of biomolecular simulation, quantum chemistry, and materials science.

People

At the heart of the MolSSI's effort is a team of molecular scientists, computer scientists, and applied mathematicians with advanced software engineering expertise. The MolSSI team is made up of the Board of Directors, the Science and Software Advisory Board, and the Software Scientists, and the Software Fellows.

Resources

The MolSSI provides access to both software tools and educational materials relevant to the computational molecular sciences. We welcome community contributions to the available resources.

Education & Outreach

The MolSSI supports a series of community-led workshops targeting software-related challenges relevant to the computational molecular sciences, as well as numerous Software Summer Schools focused on students across the U.S.

News & Events

Look here for information about upcoming MolSSI-sponsored events, as well as details regarding Software Fellowships, open Software Scientist positions, and much more.

MolSSI Workshop: MolSSI Driver Interface (MDI)

MolSSI Workshop: MolSSI Driver Interface (MDI)

Organizers: Taylor Barnes and Benjamin Pritchard (MolSSI) Location:  MolSSI Headquarters, Blacksburg, Virginia Dates: 8-10 June 2020 The recent release of the MolSSI

2020 MolSSI Community-Led Workshops

2020 MolSSI Community-Led Workshops

2020 MolSSI Software Workshops The Molecular Sciences Software Institute (MolSSI) is pleased to announce a call for proposals for its

Congratulations to the 2020-A MolSSI Investment Software Fellows!

Congratulations to the 2020-A MolSSI Investment Software Fellows!

After reviewing nearly 60 impressive applications, the MolSSI is pleased to announce that the Science and Software Advisory Board has

Congratulations to the 2020-A MolSSI Seed Software Fellows!

Congratulations to the 2020-A MolSSI Seed Software Fellows!

After reviewing nearly 60 impressive applications, the MolSSI is pleased to announce that the Science and Software Advisory Board has