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TopFor v1.0.0 – Initial Release
This is the initial public release of TopFor, an automated computational pipeline for generating AMBER-compatible force field parameters and topology for noncanonical amino acids (ncAAs).
Key Features
- Automated parameterization of non-canonical amino acids.
- Generation of AMBER-compatible topology and parameter files.
- Streamlined preparation of ncAAs for molecular dynamics simulations.
- Support for reproducible and scalable molecular parameterization workflows.
Publication
This release accompanies the TopFor research manuscript, currently available as a preprint on bioRxiv.