next up previous contents
Next: The main input file Up: Description of the molecular Previous: Dihedral angles

Optional features of the force field

Description of the optional features of the force field begins with the line defining the type of additional potential features. These are:

Examples of .mmol files are included into moldb directory. For big molecules, procedure of writing .mmol files may be somewhat automatized by the utility makemol.


next up previous contents
Next: The main input file Up: Description of the molecular Previous: Dihedral angles
Alexander Lyubartsev
2007-01-02