OpenFreeEnergy / OpenFreeEnergy/openfe

documentation request: fully worked example for solvation free energy of a protein

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@IAlibay is already working on this.

Since Jan 8, 2026.

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Description

Documentation request: could you please provide a fully worked example that computes the solvation free energy of a protein? I'm particularly interested in the case where the protein is an antibody.

I apologize if this is out of scope for OpenFE.

Thanks very much,

David Jaffe
Cofounder
Infinimmune
Alameda, CA, USA

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