GROMACS is a versatile and extremely well optimized package to perform molecular dynamics computer simulations and subsequent trajectory analysis. It is developed for biomolecules like proteins, but the extremely high performance means it is used also in several other field like polymer chemistry and solid state physics.
| Package Version | Update ID | Released | Package Hub Version | Platforms | Subpackages |
|---|---|---|---|---|---|
| 2021.2-bp154.1.56 info | GA Release | 2022-05-12 | 15 SP4 |
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| 2019.6-bp153.1.1 info | GA Release | 2021-04-20 | 15 SP3 |
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| 2018.4-bp152.3.56 info | GA Release | 2020-06-23 | 15 SP2 |
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| 2018.4-bp151.2.1 info | GA Release | 2019-07-16 | 15 SP1 |
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| 2018.4-bp151.1.13 info | GA Release | 2019-05-18 | 15 SP1 |
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| 2018.4-bp151.1.20 info | GA Release | 2019-05-18 | 15 SP1 |
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| 2018.1-bp150.2.4 info | GA Release | 2018-07-30 | 15 |
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| 2018.1-bp150.2.5 info | GA Release | 2018-07-30 | 15 |
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| 2018.1-bp150.2.6 info | GA Release | 2018-07-30 | 15 |
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| 2016.3-2.1 info | openSUSE-2017-599 | 2017-05-19 | 12 GA-SP5 |
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