From: Warren D. <wa...@de...> - 2006-03-20 19:39:14
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Alan, > Is PyMol able to save the built protein/molecule in a PDB=20 > file with CONECT information. If so, how to do it? Yes, set pdb_conect_all before saving the pdb file in order to get a PDB file with explicit connectivity and valences for all atoms. Cheers, Warren -- Warren L. DeLano, Ph.D. =20 Principal Scientist . DeLano Scientific LLC =20 . 400 Oyster Point Blvd., Suite 213 =20 . South San Francisco, CA 94080 USA =20 . Biz:(650)-872-0942 Tech:(650)-872-0834 =20 . Fax:(650)-872-0273 Cell:(650)-346-1154 . mailto:wa...@de... =20 =20 > -----Original Message----- > From: pym...@li...=20 > [mailto:pym...@li...] On Behalf Of Alan > Sent: Monday, March 20, 2006 11:39 AM > To: Pymol > Subject: [PyMOL] Saving PDB with CONECT information >=20 > Hello List! >=20 > Is PyMol able to save the built protein/molecule in a PDB=20 > file with CONECT information. If so, how to do it? >=20 > Thanks in advance for any help. >=20 > Cheers, > Alan > -- > Alan Wilter S. da Silva, D.Sc. - Research Associate=20 > Department of Biochemistry, University of Cambridge. > 80 Tennis Court Road, Cambridge CB2 1GA, UK. >=20 >=20 > ------------------------------------------------------- > This SF.Net email is sponsored by xPML, a groundbreaking=20 > scripting language that extends applications into web and=20 > mobile media. Attend the live webcast and join the prime=20 > developer group breaking into this new coding territory! > http://sel.as-us.falkag.net/sel?cmd=3Dk&kid=110944&bid$1720&dat=121642 > _______________________________________________ > PyMOL-users mailing list > PyM...@li... > https://lists.sourceforge.net/lists/listinfo/pymol-users >=20 >=20 >=20 >=20 |