That is a simple question with a long and tedious answer.

The question is like: "I have this protein crystal, can you suggest some ways to solve the structure"?

The best is to leave this to an expert in the field (I am not a real expert in this field, but I can give you some pointers of the list, if you want)

Greetings

Gert


On 16-12-2017 23:01, chemocev marker wrote:
Hi
I am just calculating the Electrostatic Potential, and I wanted to know your opinion which force field is better.What is criteria to choose and not to choose the pKA...

best

Jiri

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