patching gromacs 2022.3 with plumed 2.8.

[Alfredo Cardenas]

Dear Plumed users/developers,

I wanted to update both the gromacs and plumed versions I use for my simulations. The plumed documentation for V 2.8 states that there is a patch for gromacs 2022.3 but running the patch command the latest patch for gromacs was for V. 2021.4. I tried to use that patch but got several hunks failures. I wonder if a patch for those version is coming soon.

Thanks,

Alfredo 

[Qinghua Liao]

Hello Alfredo,

The patches were updated, you have to download the patches (v2.8) from github, and compile it with Gromacs 2022.3.

It worked for me!

All the best,

Qinghua

[Alfredo Cardenas]

Thanks Qinghua, 

It works for me too

Alfredo

[Yogendra Patel]

Dear users,

What changes do we have to make for proper patching of the above said version of Gromacs and plumed?

I am following the instructions given on the plumed site. But it could not show the patching of gromacs v2022.3 while performing command (e.g. plumed patch -p). It's not working for me. An explanation of the solution will be much appreciated.

Thanking all

[Qinghua Liao]

Hello,

As I mentioned, you have to download the patches from github,

the patches were updated there.

All the best,

Qinghua

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