PROTEAN is a set of Fortran subroutines for calculating the equations ofmotion in torsion space for polypeptides. Torsion space is the space of all rotatable bonds. Bond lengths and bond angles remain fixed at their ideal values in a torsion space simulation. Simulations in torsion space are at least ten times more efficient than simulations in Cartesian space.
- Fortran compiler
:: MORE INFORMATION
Bystroff, C. (2001)
An alternative derivation of the equations of motion in torsion space for a branched linear chain.
Protein Engineering 14, 825-828.