does anybody know a freeware program that can put partial charges as
an
extra column in a PDB-file ? (the 'PDBQ' format, as recognized by the
Autodock program).
Thanks,
Filip Van Petegem
-- =========================================================== Filip Van Petegem Laboratory for Protein Biochemistry and Protein Engineering Department of Biochemistry Physiology and Microbiology K.L. Ledeganckstraat 35 Tel: (32)-9-264-5127 BP 9000 GENT Fax: (32)-9-264-5338 BELGIUM E-mail: Filip.VanPetegem@.rug.ac.be ===========================================================