@@ -36,7 +36,7 @@ json_ld:
3636 ratingValue : 5
3737 softwareRequirements : See https://www.eessi.io/docs/ for how to make EESSI available
3838 on your system
39- softwareVersion : ' ['' 2025.4'' , '' 2025.2'' , '' 2024.4'' , '' 2024.3'' , '' 2024.1'' ]'
39+ softwareVersion : ' ['' 2026.2 '' , '' 2025.4'' , '' 2025.2'' , '' 2024.4'' , '' 2024.3'' , '' 2024.1'' ]'
4040 url : https://www.gromacs.org
4141---
4242# GROMACS
@@ -59,6 +59,7 @@ It also contains the gmxapi extension for the single precision MPI build.
5959
6060| GROMACS version| Supported CPU targets| Supported GPU targets| EESSI version| Module|
6161| --- | --- | --- | --- | --- |
62+ | 2026.2| ` generic ` : ` aarch64 ` , ` x86_64 ` <br /><span class =" software-cpu-arm " >Arm</span >: ` a64fx ` , ` neoverse_n1 ` , ` neoverse_v1 ` , ` nvidia/grace ` <br /><span class =" software-cpu-amd " >AMD</span >: ` zen2 ` , ` zen3 ` , ` zen4 ` <br /><span class =" software-cpu-intel " >Intel</span >: ` haswell ` , ` skylake_avx512 ` , ` sapphirerapids ` , ` icelake ` , ` cascadelake ` <br />| * (none)* | <span class =" software-eessi-version-202506 " >2025.06</span >| ` GROMACS/2026.2-foss-2025b ` |
6263| 2025.4| ` generic ` : ` aarch64 ` , ` x86_64 ` <br /><span class =" software-cpu-arm " >Arm</span >: ` a64fx ` , ` neoverse_n1 ` , ` neoverse_v1 ` , ` nvidia/grace ` <br /><span class =" software-cpu-amd " >AMD</span >: ` zen2 ` , ` zen3 ` , ` zen4 ` <br /><span class =" software-cpu-intel " >Intel</span >: ` haswell ` , ` skylake_avx512 ` , ` sapphirerapids ` , ` icelake ` , ` cascadelake ` <br />| * (none)* | <span class =" software-eessi-version-202506 " >2025.06</span >| ` GROMACS/2025.4-foss-2025b ` |
6364| 2025.2| ` generic ` : ` aarch64 ` , ` x86_64 ` <br /><span class =" software-cpu-arm " >Arm</span >: ` a64fx ` , ` neoverse_n1 ` , ` neoverse_v1 ` , ` nvidia/grace ` <br /><span class =" software-cpu-amd " >AMD</span >: ` zen2 ` , ` zen3 ` , ` zen4 ` <br /><span class =" software-cpu-intel " >Intel</span >: ` haswell ` , ` skylake_avx512 ` , ` sapphirerapids ` , ` icelake ` , ` cascadelake ` <br />| * (none)* | <span class =" software-eessi-version-202506 " >2025.06</span >| ` GROMACS/2025.2-foss-2025a ` |
6465| 2024.4| ` generic ` : ` aarch64 ` , ` x86_64 ` <br /><span class =" software-cpu-arm " >Arm</span >: ` neoverse_n1 ` , ` neoverse_v1 ` , ` nvidia/grace ` <br /><span class =" software-cpu-amd " >AMD</span >: ` zen2 ` , ` zen3 ` , ` zen4 ` <br /><span class =" software-cpu-intel " >Intel</span >: ` haswell ` , ` skylake_avx512 ` , ` sapphirerapids ` , ` icelake ` , ` cascadelake ` <br />| <span class =" software-gpu-nvidia " >NVIDIA</span >: ` cc70 ` , ` cc80 ` , ` cc90 ` <br />| <span class =" software-eessi-version-202306 " >2023.06</span >| ` GROMACS/2024.4-foss-2023b-CUDA-12.4.0 ` |
@@ -77,6 +78,6 @@ Overview of extensions included in GROMACS installations
7778
7879| ` gmxapi ` version| GROMACS modules that include it|
7980| --- | --- |
80- | 0.5.0a1| ` GROMACS/2025.4-foss-2025b ` |
81+ | 0.5.0a1| ` GROMACS/2026.2-foss-2025b ` < br /> ` GROMACS/ 2025.4-foss-2025b` |
8182| 0.5.0| ` GROMACS/2024.1-foss-2023b ` |
8283| 0.4.2| ` GROMACS/2025.2-foss-2025a ` <br />` GROMACS/2024.4-foss-2023b-CUDA-12.4.0 ` <br />` GROMACS/2024.4-foss-2023b ` <br />` GROMACS/2024.3-foss-2023b-PLUMED-2.9.2 ` <br />` GROMACS/2024.3-foss-2023b ` |
0 commit comments