avogadro-discuss

Messages by Date

2013/06/17 [Avogadro-Discuss] CML, NWChem, FoX, Avogadro paper Marcus D. Hanwell
2013/06/01 Re: [Avogadro-Discuss] Avogadro-Discuss Digest, Vol 46, Issue 6 Raja Sekhar
2013/05/31 Re: [Avogadro-Discuss] Avogadro-Discuss Digest, Vol 46, Issue 6 Raja Sekhar
2013/05/31 Re: [Avogadro-Discuss] Question about Avogadro bonds display Tir
2013/05/31 Re: [Avogadro-Discuss] Question about Avogadro bonds display Geoffrey Hutchison
2013/05/31 [Avogadro-Discuss] Question about Avogadro bonds display Tir
2013/05/30 Re: [Avogadro-Discuss] creating *.mol file David Lonie
2013/05/29 Re: [Avogadro-Discuss] Calculation of molecular dimensions lgontran
2013/05/29 [Avogadro-Discuss] creating *.mol file Brent Friesen
2013/05/29 Re: [Avogadro-Discuss] Calculation of molecular dimensions lgontran
2013/05/28 Re: [Avogadro-Discuss] Calculation of molecular dimensions Geoffrey Hutchison
2013/05/26 [Avogadro-Discuss] Calculation of molecular dimensions Arnout D'Haese
2013/05/26 Re: [Avogadro-Discuss] Avogadro-Discuss Digest, Vol 46, Issue 4 murpholino peligro
2013/05/22 Re: [Avogadro-Discuss] The defect site changes place after rotation! 李文凡
2013/05/21 Re: [Avogadro-Discuss] The defect site changes place after rotation! David Lonie
2013/05/21 Re: [Avogadro-Discuss] The defect site changes place after rotation! 李文凡
2013/05/21 Re: [Avogadro-Discuss] The defect site changes place after rotation! David Lonie
2013/05/21 Re: [Avogadro-Discuss] The defect site changes place after rotation! 李文凡
2013/05/21 Re: [Avogadro-Discuss] The defect site changes place after rotation! David Lonie
2013/05/20 Re: [Avogadro-Discuss] How to change the color of the unit cell box? 李文凡
2013/05/20 Re: [Avogadro-Discuss] How to change the color of the unit cell box? David Lonie
2013/05/17 [Avogadro-Discuss] How to change the color of the unit cell box? 李文凡
2013/05/17 Re: [Avogadro-Discuss] The input is not formatted as one of the following supported formats: VASP Format 李文凡
2013/05/16 Re: [Avogadro-Discuss] NWChem Vibrations & Avogadro Geoffrey Hutchison
2013/05/16 Re: [Avogadro-Discuss] Avogadro up-to-date Geoffrey Hutchison
2013/05/14 [Avogadro-Discuss] Custom color Dr. Attila Bende
2013/05/14 Re: [Avogadro-Discuss] read gaussian input file? Geoffrey Hutchison
2013/05/14 Re: [Avogadro-Discuss] read gaussian input file? Andrew Yeung
2013/05/14 Re: [Avogadro-Discuss] read gaussian input file? Marcus D. Hanwell
2013/05/12 [Avogadro-Discuss] read gaussian input file? Randy Bin Lin
2013/05/10 Re: [Avogadro-Discuss] NWChem Vibrations & Avogadro Matthew R . Siebert
2013/05/06 [Avogadro-Discuss] Avogadro up-to-date holgermw
2013/05/02 [Avogadro-Discuss] could the Avogadro show the Mulliken charges Su Su
2013/04/30 [Avogadro-Discuss] Fwd: [Avogadro-Translations] German Videotutorial for drawing molecules in Avogadro Geoffrey Hutchison
2013/04/30 Re: [Avogadro-Discuss] segfault or reading ABINIT file Cohen, Ron
2013/04/30 Re: [Avogadro-Discuss] segfault or reading ABINIT file Marcus D. Hanwell
2013/04/30 Re: [Avogadro-Discuss] segfault or reading ABINIT file David Lonie
2013/04/30 Re: [Avogadro-Discuss] Questions about: number of chemical bonds and different force fields Marcus D. Hanwell
2013/04/30 [Avogadro-Discuss] Questions about: number of chemical bonds and different force fields Carlos Guilherme Goncalves de Azevedo
2013/04/28 [Avogadro-Discuss] regarding error in compiling avogadro Dr. Amar Bahadur
2013/04/25 Re: [Avogadro-Discuss] The input is not formatted as one of the following supported formats: VASP Format David Lonie
2013/04/25 [Avogadro-Discuss] The input is not formatted as one of the following supported formats: VASP Format 李文凡
2013/04/23 Re: [Avogadro-Discuss] Reg- compiling error Avogadro David Lonie
2013/04/23 [Avogadro-Discuss] Reg- compiling error Avogadro Dr. Amar Bahadur
2013/04/23 [Avogadro-Discuss] twice fails when selecting result from plot Cohen, Ron
2013/04/23 Re: [Avogadro-Discuss] twice fails when selecting result from plot Cohen, Ron
2013/04/23 Re: [Avogadro-Discuss] twice fails when selecting result from plot Cohen, Ron
2013/04/23 [Avogadro-Discuss] Substitute the Mouse Arief Hydayat
2013/04/22 Re: [Avogadro-Discuss] problem with libpng(no atom display) David Lonie
2013/04/18 Re: [Avogadro-Discuss] problem with libpng(no atom display) Ganesh, Panchapakesan
2013/04/11 [Avogadro-Discuss] First Avogadro 2 beta release Marcus D. Hanwell
2013/04/05 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting fredrik haeffner
2013/04/05 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting Fred Ziegler
2013/04/05 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting Geoffrey Hutchison
2013/04/05 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting Fred Ziegler
2013/04/05 Re: [Avogadro-Discuss] problem with libpng(no atom display) Benjamin
2013/04/05 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting fredrik haeffner
2013/04/04 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting Geoffrey Hutchison
2013/04/03 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting fredrik haeffner
2013/04/03 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting fredrik haeffner
2013/04/03 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting Geoffrey Hutchison
2013/04/03 Re: [Avogadro-Discuss] Avogadro crashing when copying-pasting fredrik haeffner
2013/04/01 Re: [Avogadro-Discuss] Problem with libpng Geoffrey Hutchison
2013/03/30 [Avogadro-Discuss] Problem with libpng Benjamin ABEL
2013/03/17 Re: [Avogadro-Discuss] xyz to gzmat Geoffrey Hutchison
2013/03/15 [Avogadro-Discuss] xyz to gzmat Ibrahim (Ibrahim Awad) Awad
2013/03/15 Re: [Avogadro-Discuss] building slab with avogadro Geoffrey Hutchison
2013/03/15 Re: [Avogadro-Discuss] building slab with avogadro Rupashree Shyama Ray
2013/03/15 Re: [Avogadro-Discuss] building slab with avogadro David Lonie
2013/03/14 Re: [Avogadro-Discuss] building slab with avogadro Rupashree Shyama Ray
2013/03/12 Re: [Avogadro-Discuss] Problem loading files through a python extension Geoffrey Hutchison
2013/03/12 Re: [Avogadro-Discuss] installation problems Marcus D. Hanwell
2013/03/12 Re: [Avogadro-Discuss] installation problems Cohen, Ron
2013/03/12 Re: [Avogadro-Discuss] installation problems Marcus D. Hanwell
2013/03/12 Re: [Avogadro-Discuss] Problem loading files through a python extension Marcus D. Hanwell
2013/03/12 Re: [Avogadro-Discuss] Avogadro to lammps Marcus D. Hanwell
2013/03/07 Re: [Avogadro-Discuss] installation problems Geoffrey Hutchison
2013/03/07 [Avogadro-Discuss] Problem loading files through a python extension Mason, Nicholas
2013/03/07 [Avogadro-Discuss] installation problems Cohen, Ron
2013/03/06 [Avogadro-Discuss] Avogadro to lammps Ibrahim (Ibrahim Awad) Awad
2013/03/05 Re: [Avogadro-Discuss] Where to click on a hydrogen Noel O'Boyle
2013/03/05 Re: [Avogadro-Discuss] Where to click on a hydrogen Marcus D. Hanwell
2013/03/05 [Avogadro-Discuss] Where to click on a hydrogen Noel O'Boyle
2013/03/04 Re: [Avogadro-Discuss] Crashing Geoffrey Hutchison
2013/03/04 [Avogadro-Discuss] Crashing Fred Ziegler
2013/03/04 Re: [Avogadro-Discuss] rotating a bond Isidoro A . Gómez Parrales
2013/03/03 Re: [Avogadro-Discuss] rotating a bond David Lonie
2013/03/02 [Avogadro-Discuss] rotating a bond Isidoro A . Gómez Parrales
2013/03/01 Re: [Avogadro-Discuss] building slab with avogadro Geoffrey Hutchison
2013/02/28 Re: [Avogadro-Discuss] building slab with avogadro Rupashree Shyama Ray
2013/02/28 Re: [Avogadro-Discuss] building slab with avogadro Geoffrey Hutchison
2013/02/27 Re: [Avogadro-Discuss] Unit cell builder David Lonie
2013/02/27 [Avogadro-Discuss] Unit cell builder Richard Overstreet
2013/02/23 Re: [Avogadro-Discuss] Change box size in Avogadro Geoffrey Hutchison
2013/02/21 [Avogadro-Discuss] Change box size in Avogadro A. Gil Santos
2013/02/20 [Avogadro-Discuss] building slab with avogadro Rupashree Shyama Ray
2013/02/14 Re: [Avogadro-Discuss] follow-up on GAMESS logfiles crashing Avogadro 1.1.0 Geoffrey Hutchison
2013/02/14 [Avogadro-Discuss] follow-up on GAMESS logfiles crashing Avogadro 1.1.0 Blake Mertz
2013/02/13 Re: [Avogadro-Discuss] Problem with a cube file Eduard Matito
2013/02/11 Re: [Avogadro-Discuss] Problem with a cube file Geoffrey Hutchison
2013/02/09 Re: [Avogadro-Discuss] crash loading GAMESS log files David Lonie
2013/02/03 Re: [Avogadro-Discuss] Avogadro crashing and kekulize Jens Thomas
2013/02/03 Re: [Avogadro-Discuss] Avogadro crashing and kekulize Geoffrey Hutchison
2013/02/03 [Avogadro-Discuss] Fwd: A Mockup & Proposal from Zazzle... Geoffrey Hutchison
2013/02/03 Re: [Avogadro-Discuss] Avogadro 1.1.0 cannot deal with files with certain names? Xing Yin
2013/02/03 Re: [Avogadro-Discuss] Avogadro 1.1.0 cannot deal with files with certain names? Geoffrey Hutchison
2013/02/03 Re: [Avogadro-Discuss] Avogadro 1.1.0 cannot deal with files with certain names? David Lonie
2013/02/03 Re: [Avogadro-Discuss] Avogadro 1.1.0 cannot deal with files with certain names? David Lonie
2013/02/03 Re: [Avogadro-Discuss] Avogadro 1.1.0 cannot deal with files with certain names? David Lonie
2013/02/03 Re: [Avogadro-Discuss] Binary RPM for CentOS 5.8 ... ?? David Lonie
2013/02/01 [Avogadro-Discuss] Binary RPM for CentOS 5.8 ... ?? Richard Walsh
2013/01/23 Re: [Avogadro-Discuss] Avogadro SuSe-Version problems Geoffrey Hutchison
2013/01/21 Re: [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu Marcus D. Hanwell
2013/01/21 Re: [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu Jens Thomas
2013/01/21 Re: [Avogadro-Discuss] Inability to calculate carbon dioxide dipole moment? Geoffrey Hutchison
2013/01/21 Re: [Avogadro-Discuss] Inability to calculate carbon dioxide dipole moment? Marcus D. Hanwell
2013/01/21 Re: [Avogadro-Discuss] Inability to calculate carbon dioxide dipole moment? Noel O'Boyle
2013/01/20 Re: [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu Marcus D. Hanwell
2013/01/20 Re: [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu Geoffrey Hutchison
2013/01/19 Re: [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu fredrik haeffner
2013/01/19 Re: [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu Marcus D. Hanwell
2013/01/19 Re: [Avogadro-Discuss] Inability to calculate carbon dioxide dipole moment? Marcus D. Hanwell
2013/01/19 Re: [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu Marcus D. Hanwell
2013/01/19 [Avogadro-Discuss] Inability to calculate carbon dioxide dipole moment? Steven Petrovic
2013/01/19 [Avogadro-Discuss] cut-n-paste in Avogadro running on Ubuntu fredrik haeffner
2013/01/10 [Avogadro-Discuss] Avogadro paper published in final form Marcus D. Hanwell
2012/12/18 [Avogadro-Discuss] What is occupancy means in CIF file Indra Gunawan
2012/12/17 Re: [Avogadro-Discuss] Positioning a molecule on a surface Geoffrey Hutchison
2012/12/17 [Avogadro-Discuss] Positioning a molecule on a surface Didier Sebilleau
2012/12/17 [Avogadro-Discuss] export an IR spectra image to a jpeg format? Alex Balboa
2012/12/10 Re: [Avogadro-Discuss] Questions about dipole moments Steven Petrovic
2012/12/10 Re: [Avogadro-Discuss] Questions about dipole moments Geoffrey Hutchison
2012/12/09 [Avogadro-Discuss] Questions about dipole moments Steven Petrovic
2012/12/09 Re: [Avogadro-Discuss] Applying Constraints to Nwchem Files Geoffrey Hutchison
2012/11/15 [Avogadro-Discuss] Remove all H except polar H John Doe
2012/11/12 Re: [Avogadro-Discuss] NWChem Vibrations & Avogadro Geoff Hutchison
2012/11/09 Re: [Avogadro-Discuss] NWChem Vibrations & Avogadro Andrew Yeung
2012/11/09 Re: [Avogadro-Discuss] NWChem Vibrations & Avogadro Geoffrey Hutchison
2012/11/09 [Avogadro-Discuss] NWChem Vibrations & Avogadro Andrew Yeung
2012/10/31 Re: [Avogadro-Discuss] atom Geoff Hutchison
2012/10/26 Re: [Avogadro-Discuss] silent installation of avogadro on windows (windows 7) Niek Buurma
2012/10/26 Re: [Avogadro-Discuss] please do me a favour, answer my question Steven Wathen
2012/10/26 [Avogadro-Discuss] please do me a favour, answer my question maryam golbabaee
2012/10/25 Re: [Avogadro-Discuss] silent installation of avogadro on windows (windows 7) Geoffrey Hutchison
2012/10/25 [Avogadro-Discuss] silent installation of avogadro on windows (windows 7) Niek Buurma
2012/10/24 [Avogadro-Discuss] i have a question maryam golbabaee
2012/10/23 Re: [Avogadro-Discuss] ions Ryn Shuster
2012/10/22 [Avogadro-Discuss] chirality William
2012/10/22 Re: [Avogadro-Discuss] ions Geoffrey Hutchison
2012/10/18 [Avogadro-Discuss] ions Shuster, Ryn
2012/09/19 Re: [Avogadro-Discuss] Configure Avogadro on Cent OS Marcus D. Hanwell
2012/09/18 Re: [Avogadro-Discuss] Configure Avogadro on Cent OS Ismail, Mohd F.
2012/09/17 Re: [Avogadro-Discuss] GAFF use John Doe
2012/09/15 Re: [Avogadro-Discuss] GAFF use José Fernando Ruggiero Bachega
2012/09/15 Re: [Avogadro-Discuss] Configure Avogadro on Cent OS Geoff Hutchison
2012/09/15 Re: [Avogadro-Discuss] Configure Avogadro on Cent OS Ismail, Mohd F.
2012/09/15 [Avogadro-Discuss] GAFF use John Doe
2012/09/14 [Avogadro-Discuss] Configure Avogadro on Cent OS Ismail, Mohd F.
2012/09/14 Re: [Avogadro-Discuss] Changing radius of individual atoms Ismail, Fyaz
2012/09/12 [Avogadro-Discuss] Avogadro 1.1.0 Released Marcus D. Hanwell
2012/08/26 Re: [Avogadro-Discuss] DNA editor Geoff Hutchison
2012/08/26 Re: [Avogadro-Discuss] DNA editor Philip Rhoades
2012/08/24 [Avogadro-Discuss] question about pharmer engine in Avogadro rochoa
2012/08/19 Re: [Avogadro-Discuss] bonds across periodic boundary elleB
2012/08/13 [Avogadro-Discuss] Avogadro paper pre-publication Noel O'Boyle
2012/08/12 Re: [Avogadro-Discuss] Changing radius of individual atoms Dzik, Walter H.,M.D.
2012/08/12 Re: [Avogadro-Discuss] Changing radius of individual atoms Geoff Hutchison
2012/08/12 Re: [Avogadro-Discuss] Changing radius of individual atoms Dzik, Walter H.,M.D.
2012/08/12 Re: [Avogadro-Discuss] Changing radius of individual atoms David Lonie
2012/08/12 [Avogadro-Discuss] Changing radius of individual atoms Dzik, Walter H.,M.D.
2012/08/06 Re: [Avogadro-Discuss] bonds across periodic boundary David Lonie
2012/08/06 [Avogadro-Discuss] bonds across periodic boundary elleB
2012/07/28 [Avogadro-Discuss] For avogadro discussion Charithea Charalambous
2012/07/26 [Avogadro-Discuss] Avogadro Lunch @ ACS Philadelphia Meeting on Aug. 21st Geoffrey Hutchison
2012/07/22 Re: [Avogadro-Discuss] GPU acceleration, Avogadro 2.0 Geoff Hutchison
2012/07/21 Re: [Avogadro-Discuss] GPU acceleration, Avogadro 2.0 James Ryley
2012/07/21 Re: [Avogadro-Discuss] GPU acceleration, Avogadro 2.0 Geoff Hutchison
2012/07/18 Re: [Avogadro-Discuss] GPU acceleration, Avogadro 2.0 James Ryley
2012/07/18 Re: [Avogadro-Discuss] GPU acceleration, Avogadro 2.0 Geoff Hutchison
2012/07/18 [Avogadro-Discuss] GPU acceleration, Avogadro 2.0 James Ryley
2012/07/16 Re: [Avogadro-Discuss] povray Steven Wathen
2012/07/16 Re: [Avogadro-Discuss] povray David Lonie
2012/07/15 [Avogadro-Discuss] povray Charles Reilly
2012/07/12 [Avogadro-Discuss] examples for orbitals and exporting orbital geometry Charles Reilly
2012/06/26 Re: [Avogadro-Discuss] Selection of rotatable bonds in Avogadro Geoffrey Hutchison
2012/06/25 [Avogadro-Discuss] Selection of rotatable bonds in Avogadro Reinhard Vetter
2012/06/23 Re: [Avogadro-Discuss] Display background image John 37309
2012/06/22 Re: [Avogadro-Discuss] Display background image Geoffrey Hutchison
2012/06/22 [Avogadro-Discuss] Display background image John 37309
2012/06/19 [Avogadro-Discuss] Defining rotatable bonds in Avogadro Reinhard Vetter
2012/06/05 Re: [Avogadro-Discuss] Problem with a cube file Roberto Di Remigio
2012/06/05 Re: [Avogadro-Discuss] Problem with a cube file Geoff Hutchison
2012/06/05 Re: [Avogadro-Discuss] Problem with a cube file Eric Isaacs
2012/06/02 [Avogadro-Discuss] problem with basis sets format Nagat Mohammed
2012/05/18 Re: [Avogadro-Discuss] Teaching and Walk-Throughs Jens Thomas
2012/05/18 Re: [Avogadro-Discuss] Teaching and Walk-Throughs eric henon
2012/05/18 Re: [Avogadro-Discuss] [Avogadro-devel] Avogadro Manuscript Egon Willighagen
2012/05/18 Re: [Avogadro-Discuss] [Avogadro-devel] Avogadro Manuscript Egon Willighagen
2012/05/18 Re: [Avogadro-Discuss] [Avogadro-devel] Avogadro Manuscript My Th
2012/05/17 Re: [Avogadro-Discuss] [Avogadro-devel] Avogadro Manuscript Geoffrey Hutchison