MolSSI (@MolSSI

MolSSI

1,955 posts

MolSSI

@MolSSI_NSF

A nexus for science, education & cooperation serving the global community of computational molecular scientists.

Blacksburg, VA

Joined January 2017

MolSSI
@MolSSI_NSF
Jul 17
🎉 We're excited to welcome attendees to the 2026 MERCURY Conference next week at Virginia Tech! Hosted by MolSSI, this annual meeting brings together the undergraduate computational chemistry community for research, collaboration, and hands-on learning. mercury26.molssi.org
MolSSI
@MolSSI_NSF
Jul 16
📢 New MolSSI Pub Alert! Congratulations to Moses Chung (@MosesChung11), our 2024–25 Software Fellow, on his lead authorship of the new JCP publication, "Development and application of external electric fields for advanced polarizable force fields." 🎉 📖
pubs.aip.org
Development and application of external electric fields for advanced polarizable force fields
External electric fields can dramatically alter the structure and dynamics of molecules and materials. The electric field response involves both the direct elec
MolSSI
@MolSSI_NSF
Jul 10
🚀 NEW ONLINE MolSSI WORKSHOP: "AI-Assisted Development Best Practices" (July 27–28, 1–5 PM ET). Learn hands-on strategies for using AI tools safely and effectively. Registration is limited to 200 participants, so reserve your spot today! molssi.org/the-molssi-ai-…
MolSSI
@MolSSI_NSF
Jul 9
Join the MolSSI AI-Assisted Development Best Practices Workshop (July 27-28, 2026)! - mailchi.mp/molssi.org/upc…
MolSSI
@MolSSI_NSF
Jun 22
ONE WEEK left to register for the 2026 MERCURY Conference on Computational Chemistry @ Virginia Tech ( (registration closes on 6/29)! Include the free “Molecular Docking with Python” workshop on July 21 in your week of learning and engagement! mercury26.molssi.org #CompChem