Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-28 Thread Bob Hanson
in what context? Warren Gallagher wrote: >27. Sep, 2006 > >On Sep 27, 2006, at 8:25 PM, Bob Hanson wrote: > > >>thank you. Keep 'em coming. >> >> >> > > The "hbonds" command no longer seems to work. It appears you have to >go all the way back to version 10.0 to get it to work. Is th

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-28 Thread Angel Herraez
Hi Warren Starting 10.2, you have to use "hbonds claculate" before the first "hbonds on" (unless the pdb file provides specification of Hbonds, which is what "hbonds on" will show without "calculate". Most pdb files don't have such. El 27 Sep 2006 a las 23:49, Warren Gallagher escribió: > 27.

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-27 Thread Warren Gallagher
27. Sep, 2006 On Sep 27, 2006, at 8:25 PM, Bob Hanson wrote: > thank you. Keep 'em coming. > The "hbonds" command no longer seems to work. It appears you have to go all the way back to version 10.0 to get it to work. Is this command still supported or has it been replaced with somethi

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-27 Thread Bob Hanson
thank you. Keep 'em coming. - Take Surveys. Earn Cash. Influence the Future of IT Join SourceForge.net's Techsay panel and you'll get the chance to share your opinions on IT & business topics through brief surveys -- and earn

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-27 Thread Eric Martz
I have inserted my responses in red. Hope this works. I did my tests with 10.9.64 and 10.9.67 applets. -Eric On 9/23/06, Bob Hanson wrote: Synopsis 1) Calcium as protein is fixed in 10.9.61. I agree that it is fixed! 2) The problem with situations where there are two groups in the same

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-23 Thread Bob Hanson
Timothy Driscoll wrote: >On Sep 23, 2006, at 9:59 AM, Bob Hanson wrote: > > >>>Jmol fails to connect some atoms with covalent bonds where there >>>should be >>>connections. >>> >>> >>> >>> >>This is an intended feature, not a bug. In many PDB/mmCIF files, the >>author has explicitly defi

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-23 Thread Timothy Driscoll
On Sep 23, 2006, at 9:59 AM, Bob Hanson wrote: > >> Jmol fails to connect some atoms with covalent bonds where there >> should be >> connections. >> >> > This is an intended feature, not a bug. In many PDB/mmCIF files, the > author has explicitly defined quite a number of bond connections using >

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-23 Thread Bob Hanson
Just a follow up on this, since I haven't heard from Eric, and 11.0 is just around the corner. This is a lengthy message. Synopsis 1) Calcium as protein is fixed in 10.9.61. 2) The problem with situations where there are two groups in the same chain with the same residue sequence numb

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-20 Thread Bob Hanson
Eric, I think I've addressed most of your concerns below. Bob Eric Martz wrote: >I am looking forward to the release of Jmol 11 which already has many >improvements and bug fixes beneficial for FirstGlance in Jmol. > >However, many bugs that I reported months ago have not, as far as I know, >b

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-19 Thread Bob Hanson
Eric Martz wrote: >Calcium ions are included in protein. > > > an easy fix. Thanks. - Take Surveys. Earn Cash. Influence the Future of IT Join SourceForge.net's Techsay panel and you'll get the chance to share your opinions

Re: [Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-19 Thread Bob Hanson
thank you, Eric. This is a terrific list. Please be sure to file these as bug reports so that they can be acted on in a timely fashion. It would be best if there is one report for each type of bug. Some of these (deuterium isotopes, for example) should be put in as a feature request, as Jmol ha

[Jmol-users] Lots of bugs in Jmol: fix some before v11?

2006-09-19 Thread Eric Martz
I am looking forward to the release of Jmol 11 which already has many improvements and bug fixes beneficial for FirstGlance in Jmol. However, many bugs that I reported months ago have not, as far as I know, been fixed. Sometimes Jmol deems certain atoms to be none of protein, nucleic, nor hete