Re: [Jmol-users] molden.input interface broken

Martin, one problem is that we don't seem to have any Molden sample files. Could you please send me a variety of those that we can put on the site and use for testing? The one below is a good start. I have a feeling the Molden reader was never tested. It's really very very basic. Let's get it

Re: [Jmol-users] molden.input interface broken

On Mi, 16 Feb 2011, Robert Hanson wrote: Martin, one problem is that we don't seem to have any Molden sample files. Could you please send me a variety of those that we can put on the site and use for testing? The one below is a good start. I have a feeling the Molden reader was never tested. It's

[Jmol-users] loading pdb files in a looping statement

Hi, Can anyone help me with the procedure of loading .pdb files in a looping statement using jmol so I don't have to upload one file at a time and perform similar operations. Regards, Vineet Joshi -- The ultimate

Re: [Jmol-users] loading pdb files in a looping statement

Hello Vineet I'm not sure what you mean. If you want to load several files, you can do load files molec1.pdb molec2.pdb molec3.pdb You could also set them in a loop, like for (var i = 1; i = 4; i = i + 1) var x = molec + i + .pdb; load append @x; end for

[Jmol-users] Support for NMR restraints

Hi guys : Does JMol support uploading of Pdb or other types of structural restraints files? Jay Vyas MMSB UCHC -- The ultimate all-in-one performance toolkit: Intel(R) Parallel Studio XE: Pinpoint memory and threading

Re: [Jmol-users] Support for NMR restraints

You mean, NMR restraints, like ftp://ftp.wwpdb.org/pub/pdb/data/structures/divided/nmr_restraints_v2/14/214d_mr.str.gz? Tell me all about them. What would you visualize? What programs read and visualize this information? Is there something that we could do with them in Jmol that hasn't been