The lead developer for the GROMACS Python API (gmxapi – see https://academic.oup.com/bioinformatics/article/34/22/3945/5038467), Dr Eric Irrgang of Prof. Peter […]
On Nov 6, the first ENCCS developer progress meeting was held. We took an in-depth look at the […]
The GROMACS team has made available a preview of version 2021. Most new features and performance are finalized, […]
GROMACS is one of the most widely-used codes in all of HPC, providing key mechanistic and energetic insight […]
