Tripos Mol2 format

    Tripos Mol2 import/export is alpha level in the current version of Marvin.

    Only the following records are imported and exported:


    • @<TRIPOS>ATOM Import: x, y, z, atom_type, charge rounded to integer Export: atom_id(=atom index), atom_name, x, y, z, atom_type, subst_id=1, subst_name="noname", charge (integer)


      Code : mol2 See also

    • Tripos SYBYL MOL format

    • Basic export options