--- search: boost: 2.0 --- # Enum: ProteinPotentialName _Force fields used to parametrize amino acids in proteins in a simulation._
URI: [https://CCPBioSim.ac.uk/biosim-schema/ProteinPotentialName](https://CCPBioSim.ac.uk/biosim-schema/ProteinPotentialName) ## Permissible Values | Value | Meaning | Description | | --- | --- | --- | | ff19SB | None | As of Amber24, ff19SB is the latest model of SB protein force fields and has ... | | ff99SB | None | All-atom molecular mechanics force field specifically designed to simulate pr... | | ff99SB-ILDN | None | Refined extension of the foundational Amber ff99SB model, specifically optimi... | | ff99SB-disp | None | Optimized by D | | ff14SB | None | Older version of the SB protein force fields that utilizes uncoupled phi/psi ... | | ff14SBonlysc | None | Includes the ff99SB backbone parameters with updated side chain (sc) paramete... | | ff15ipq | None | Continues the development begun with the ff14ipq force field for proteins, bu... | | fb15 | None | The force balance (fb) protein force field that can be used for protein-water... | | ff03 | None | A modified version of ff99, where charges are derived from quantum calculatio... | | ff03ua | None | The united-atom counterpart of ff03, which uses the dame charging scheme as f... | | phosaa10 | None | Force field for phosphorylated amino acids | | phosaa14SB | None | Force field for phosphorylated amino acids with ff14SB | | phosaa19SB | None | Force field for phosphorylated amino acids with ff19SB | | ff14SB_modAA | None | Force field with ff14SB for modified amino acids like selenomethionine, cyano... | | ff19SB_modAA | None | Force field with ff19SB for modified amino acids like selenomethionine, cyano... | ## Slots | Name | Description | | --- | --- | | [protein_potential_name](../slots/protein_potential_name.md) | Force field used to describe proteins | ## Identifier and Mapping Information ### Schema Source * from schema: https://CCPBioSim.ac.uk/biosim-schema/ ## LinkML Source ```yaml name: ProteinPotentialName description: Force fields used to parametrize amino acids in proteins in a simulation. from_schema: https://CCPBioSim.ac.uk/biosim-schema/ rank: 1000 permissible_values: ff19SB: text: ff19SB description: As of Amber24, ff19SB is the latest model of SB protein force fields and has shown to improve amino acid-dependent properties such as helical propensities and reproduces the differences in amino acid-specific PDB Ramachandran maps. ff99SB: text: ff99SB description: All-atom molecular mechanics force field specifically designed to simulate proteins and peptides ff99SB-ILDN: text: ff99SB-ILDN description: Refined extension of the foundational Amber ff99SB model, specifically optimized to fix errors in side-chain rotamer distributions. ff99SB-disp: text: ff99SB-disp description: Optimized by D.E. Shaw Research to accurately simulate both folded, structured proteins and intrinsically disordered proteins (IDPs) or highly flexible peptide states. ff14SB: text: ff14SB description: Older version of the SB protein force fields that utilizes uncoupled phi/psi dihedral parameters for the protein backbone, and every amino acid except for glycine used the backbone dihedral parameters fit using alanine. ff14SBonlysc: text: ff14SBonlysc description: Includes the ff99SB backbone parameters with updated side chain (sc) parameters that were derived from ab initio quantum mechanics calculations. ff15ipq: text: ff15ipq description: Continues the development begun with the ff14ipq force field for proteins, but offers new parameter choices, data fitting and validation. fb15: text: fb15 description: The force balance (fb) protein force field that can be used for protein-water simulations. ff03: text: ff03 description: A modified version of ff99, where charges are derived from quantum calculations that ise a continuum dielectric to mimic solvent polarization. ff03ua: text: ff03ua description: The united-atom counterpart of ff03, which uses the dame charging scheme as ff03, but the aliphatic hydrogen atoms on all amino acid side-chains are united to their corresponding carbon atoms. phosaa10: text: phosaa10 description: Force field for phosphorylated amino acids. phosaa14SB: text: phosaa14SB description: Force field for phosphorylated amino acids with ff14SB. phosaa19SB: text: phosaa19SB description: Force field for phosphorylated amino acids with ff19SB. ff14SB_modAA: text: ff14SB_modAA description: Force field with ff14SB for modified amino acids like selenomethionine, cyano-phenylalanine, and azido-phenylalanine, acetylated lysine and for the nitroxide spin-label methanesulfonothioate (MTSL). ff19SB_modAA: text: ff19SB_modAA description: Force field with ff19SB for modified amino acids like selenomethionine, cyano-phenylalanine, and azido-phenylalanine, acetylated lysine and for the nitroxide spin-label methanesulfonothioate (MTSL). ```