Open Force Field 3.0.0 Alpha Force Field Benchmarks
Open Force Field 3.0.0 Alpha Force Field Benchmarks
Summary of benchmarking results on protein structure for the Open Force Field 3.0.0 alpha force field. This is a recording of the Open Force Field Initiative Protein Force Field Meeting on October 16, 2025. The force field "openff_no-water-3.0.0-alpha0.offxml" is called "Null-4-mer-AAQAA3" in this presentation and is colored orange throughout. QM parameter fits made use of code from https://github.com/openforcefield/protein-param-fit. NMR parameter fits made use of code from https://github.com/openforcefield/protein-nmr-fit. Benchmarks of protein structure made use of code from https://github.com/openforcefield/proteinbenchmark.
- University of Colorado Boulder United States
- University of California, Irvine United States
- Memorial Sloan Kettering Cancer Center United States
- University of California, San Diego United States
- University of Pennsylvania United States
Computational Chemistry, Biophysics, Molecular Dynamics Simulation
Computational Chemistry, Biophysics, Molecular Dynamics Simulation
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