Re: [Jmol-users] Jmol 14.14.1 chirality

2017-04-22 Thread Robert Hanson
argh. Broke chirality for ketones! On Fri, Apr 21, 2017 at 11:27 AM, Robert Hanson wrote: > > > On Fri, Apr 21, 2017 at 11:10 AM, Bruce Tattershall < > bruce.tattersh...@newcastle.ac.uk> wrote: > >> Dear Bob >> >> >> >> The chirality calculation is clearly useful. >> >> >>

Re: [Jmol-users] Jmol 14.14.1 contour isosurfaces as .pmesh files

2017-04-21 Thread Bruce Tattershall
’ downloads if the files could be a bit smaller. Thanks again Bruce From: Robert Hanson [mailto:hans...@stolaf.edu] Sent: 20 April 2017 16:47 To: jmol-users@lists.sourceforge.net Subject: Re: [Jmol-users] Jmol 14.14.1 OK - this is better: Looking for the latest version? Download Jmol-14.14.1

Re: [Jmol-users] Jmol 14.14.1 chirality

2017-04-21 Thread Robert Hanson
On Fri, Apr 21, 2017 at 11:10 AM, Bruce Tattershall < bruce.tattersh...@newcastle.ac.uk> wrote: > Dear Bob > > > > The chirality calculation is clearly useful. > > > > I have tried it on my chiral phosphorus compounds, e.g. as in > >

Re: [Jmol-users] Jmol 14.14.1 chirality

2017-04-21 Thread Bruce Tattershall
To: jmol-users@lists.sourceforge.net Subject: Re: [Jmol-users] Jmol 14.14.1 OK - this is better: Looking for the latest version? Download Jmol-14.14.1-binary.zip (69.7 MB) <https://sourceforge.net/projects/jmol/files/latest/download?source=files> On Wed, Apr 19, 2017 at 11:35 PM, Robert

Re: [Jmol-users] Jmol 14.14.1

2017-04-21 Thread Pshemak Maslak
I can confirm: the command (in bold below) generated the expected closed CAP surfaces in Jmol and JSmol. Thanks Bob, PM On 4/20/2017 10:34 PM, Robert Hanson wrote: On Thu, Apr 20, 2017 at 8:35 AM, Pshemak Maslak > wrote: Bob; I am looking

Re: [Jmol-users] Jmol 14.14.1

2017-04-20 Thread Robert Hanson
On Thu, Apr 20, 2017 at 8:35 AM, Pshemak Maslak wrote: > Bob; > > I am looking forward to exploring the new R/S and E/Z functionality; it's > a great addition. > > Does this version include fix for "*spacefill ionic;lcaocartoon scale 1.0 > CAP unitcell "cpk";spacefill off" *which

Re: [Jmol-users] Jmol 14.14.1

2017-04-20 Thread Arturo Manzo-Fontes
Thanks Robert, it works fine! Best. Arturo Manzo-Fontes, Ph.D. COO *Spleißen Wege Bio, S. de R.L. de C.V.* The information contained in this e-mail is for the exclusive use of the intended recipient(s) and may be confidential, proprietary, and/or legally privileged. Inadvertent disclosure of

Re: [Jmol-users] Jmol 14.14.1

2017-04-20 Thread Pshemak Maslak
Bob; I am looking forward to exploring the new R/S and E/Z functionality; it's a great addition! Does this version include fix for "/*spacefill ionic;lcaocartoon scale 1.0 CAP unitcell "cpk";spacefill off" */which freezes the Jmol (Java) and leaves open surfaces (no "cap') on many unticell

Re: [Jmol-users] Jmol 14.14.1

2017-04-20 Thread Robert Hanson
OK - this is better: Looking for the latest version? * Download Jmol-14.14.1-binary.zip (69.7 MB) * On Wed, Apr 19, 2017 at 11:35 PM, Robert Hanson wrote: > hmm. something is missing there. I had to

Re: [Jmol-users] Jmol 14.14.1

2017-04-20 Thread Pshemak Maslak
Bob; I am looking forward to exploring the new R/S and E/Z functionality; it's a great addition. Does this version include fix for "/*spacefill ionic;lcaocartoon scale 1.0 CAP unitcell "cpk";spacefill off" */which freezes the Jmol (Java) and leaves open surfaces (no "cap') on many unticell

Re: [Jmol-users] Jmol 14.14.1

2017-04-20 Thread Pierluigi Quagliotto
Many thanks, Bob! Wonderful news! I am waiting for the availability of the release to imrpove my page on chirality and to prepare also a page to introduce all the steps needed to assign E/Z configurations. Bye! Pierluigi Il 20/04/2017 06:28, Robert Hanson ha scritto:

Re: [Jmol-users] Jmol 14.14.1

2017-04-19 Thread Robert Hanson
hmm. something is missing there. I had to delete that and will upload again. On Wed, Apr 19, 2017 at 11:28 PM, Robert Hanson wrote: > Jmol.___JmolVersion="14.14.1" // released 4/19/17 > > new feature: CALCULATE CHIRALITY {atom set} > -- starts with basic CIP Rule 1-2

Re: [Jmol-users] Jmol 14.14.1

2017-04-19 Thread Robert Hanson
link for this release: * Download Jmol-14.14.1-binary.zip (65.0 MB) * On Wed, Apr 19, 2017 at 11:28 PM, Robert Hanson wrote: > Jmol.___JmolVersion="14.14.1" // released 4/19/17 > > new feature: