Date: July 9-10, 2025 Location: Cal Poly San Luis Obispo, San Luis Obispo, CA Application: Apply Here (Deadline May 15, 2025) This workshop is designed for university faculty in the molecular sciences (chemistry, physics, molecular biology, materials science, and related disciplines) who want to learn Python programming and how to ...
Date: 2021-06-28 This fully virtual workshop will focus on parallel programming models and algorithms used in or beneficial to our community, as well as recent success stories in codes and methods development for advanced simulations in our field. One key objective of the workshop is to improve and develop the skill-sets of the next-generation of computational chemistry ...
Date: 2021-03-23 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 past four years diligently working towards general solutions to these complex problems, and are excited to announce that several MolSSI interoperability projects are ready for ...
Date: 2020-09-21 The Molecular Sciences Software Institute (MolSSI) is now accepting proposals for Software Workshops focusing on High Performance Computing (HPC). The purpose of these workshops is to bring key software developers and users together to identify and discuss the most important questions we face as a community in ...
Date: 2020-08-17 The Molecular Sciences Software Institute (MolSSI) is pleased to announce the latest Software Fellowship competition, which will focus on Seed Fellowships in the current round. These prestigious six-month Fellowships recognize advanced graduate students and postdocs pursuing the development of software infrastructure, middleware, and frameworks that will benefit the broader field of computational molecular sciences, including biomolecular ...
Date: 2020-05-18 MolSSI is pleased to announce that we will be holding a special June webinar series on our Python Data and Scripting Workshop. This workshop will be a “fast track” version of our April webinar. It will be held over the first two weeks of June, with classes taking place each Tuesday and Friday from 12 PM ...
Date: 2020-04-20 MolSSI is pleased to announce that we will be holding a May webinar series on our Python Package Development Workshop. This workshop will be held over 4 weeks, with classes taking place on four Fridays in May (May 8, May 15, May 22, and May 29) from 1 PM to 4 PM EST (Eastern Standard Time ...
Date: 2020-02-05 Organizers: Shentenu Jha and Sam Ellis Location: Virginia Tech Executive Briefing Center in Arlington, Virginia Dates: Expected Fall 2020 OVERVIEW The Centre of Excellence for Computational Biomolecular Research (BioExcel) and the Molecular Sciences Software Institute (MolSSI) are jointly organizing workshops on the development and application of workflow solutions for biomolecular modeling and simulations. This first event was hosted ...
Date: 2020-01-23 Organizers: Taylor Barnes and Benjamin Pritchard (MolSSI) Location: MolSSI Headquarters, Blacksburg, Virginia Dates: New dates to be determined. Continue to check our website The recent release of the MolSSI Driver Interface (MDI) represents a significant step towards enabling improved interoperability among computational molecular sciences codes. To assist developers in taking advantage of MDI’s capabilities and to gather feedback ...
Date: 2020-01-15 Organizers: Alicia Palacios (Universidad Autónoma de Madrid, Spain), Jimena Gorfinkiel (Open University, UK), Samantha Fonseca dos Santos (Rollins College, USA), Barry Schneider (NIST, USA), Marianna Safronova (University of Delaware, USA) Location: National Institute of Standards and Technology (NIST), Gaithersburg, Maryland, USA Dates: 11-13 December 2019 In mid-May 2018, a group of relatively senior atomic and molecular (A&M) physicists and ...