TIP4P/2005 water model

User discussions
1

GROMACS version: 2020
GROMACS modification: Yes/No
Hello everyone,

I would like to use tip4p/2005 water model in my simulation. However, I couldn’t find any of the force fields that are compatible with this water model. Can anyone help me with how to use tip4p/2005 water model in Gromacs? I appreciate!

2

Hi Lida , did you find how to use the tip4p/2005 water model in gromacs ?, if you find can you help me please !

3

We do not (yet) distribute tip4p2005 with any of the force fields in GROMACS. This is because this is a force field that is good for pure water and maybe not in combination with bio-molecules. There are many implementations on the internet. It is easy to download one of those and check the parameters.