December 2014 Archives by thread

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Starting: Mon Dec 1 07:19:06 CET 2014
Ending: Wed Dec 31 21:08:30 CET 2014
Messages: 624

• [gmx-users] Can we calculate rmsd from after energy minimization?   Seera Suryanarayana
  • [gmx-users] Can we calculate rmsd from after energy minimization?   Mark Abraham
• [gmx-users] error in PME mesh load   RINU KHATTRI
  • [gmx-users] error in PME mesh load   Mark Abraham
• [gmx-users] Free Energy calculations crash for lambdas higher than 0.8   Julian
• [gmx-users] odd replica excahnge   leila salimi
  • [gmx-users] odd replica excahnge   Mark Abraham
    • [gmx-users] odd replica excahnge   leila salimi
• [gmx-users] charmm to gromacs   Rebeca García Fandiño
  • [gmx-users] charmm to gromacs   Justin Lemkul
• [gmx-users] Define Heavy Water   xy21hb
  • [gmx-users] Define Heavy Water   Mark Abraham
• [gmx-users] g_angle   ayşe K
• [gmx-users] Отв: Position Restraint or remove COM from DNA   Justin Lemkul
• [gmx-users] Why the rmsd value has been varied from different hardware for same protein?   Seera Suryanarayana
  • [gmx-users] Why the rmsd value has been varied from different hardware for same protein?   Mark Abraham
• [gmx-users] Continuing inturepted REMD simulation   Nizar Masbukhin
  • [gmx-users] Continuing inturepted REMD simulation   Mark Abraham
    • [gmx-users] Continuing inturepted REMD simulation   Nizar Masbukhin
      • [gmx-users] Continuing inturepted REMD simulation   Mark Abraham
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 1   Seera Suryanarayana
  • [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 1   Victor Rosas Garcia
• [gmx-users] charmm to gromacs   Jernej Zidar
• [gmx-users] read trr file   Tsjerk Wassenaar
  • [gmx-users] read trr file   Patrick Fuchs
• [gmx-users] read trr file   Tsjerk Wassenaar
  • [gmx-users] read trr file   石锐
    • [gmx-users] read trr file   Tsjerk Wassenaar
      • [gmx-users] read trr file   石锐
• [gmx-users] ligand related problem   RINU KHATTRI
  • [gmx-users] ligand related problem   Justin Lemkul
• [gmx-users] Wrong profile obtained in umbrella sampling tutorial   Victor Rosas Garcia
  • [gmx-users] Wrong profile obtained in umbrella sampling tutorial   Justin Lemkul
    • [gmx-users] Wrong profile obtained in umbrella sampling tutorial   Victor Rosas Garcia
      • [gmx-users] Wrong profile obtained in umbrella sampling tutorial   Victor Rosas Garcia
      • [gmx-users] Wrong profile obtained in umbrella sampling tutorial   Justin Lemkul
      • [gmx-users] Wrong profile obtained in umbrella sampling tutorial   Victor Rosas Garcia
• [gmx-users] constrained bonds   marzieh dehghan
  • [gmx-users] constrained bonds   Justin Lemkul
• [gmx-users] no output from rms   Mark Abraham
• [gmx-users] Gromacs 5.0.1 restart simulation   wh
  • [gmx-users] Gromacs 5.0.1 restart simulation   Justin Lemkul
• [gmx-users] Install gromacs 5.0.2,ERROR   Hooman Vahidi
• [gmx-users] gromacs installation   Amir Khan
• [gmx-users] gromacs installation   Amir Khan
• [gmx-users] Query in protein insertion in membrane   Priya Das
  • [gmx-users] Query in protein insertion in membrane   Justin Lemkul
    • [gmx-users] Query in protein insertion in membrane   Priya Das
      • [gmx-users] Query in protein insertion in membrane   Justin Lemkul
      • [gmx-users] Query in protein insertion in membrane   Priya Das
      • [gmx-users] Query in protein insertion in membrane   Justin Lemkul
• [gmx-users] Different box volumes from gmxdump and g_energy   Johnny Lu
  • [gmx-users] Different box volumes from gmxdump and g_energy   Johnny Lu
    • [gmx-users] Different box volumes from gmxdump and g_energy   Mark Abraham
      • [gmx-users] Different box volumes from gmxdump and g_energy   Johnny Lu
      • [gmx-users] Different box volumes from gmxdump and g_energy   Johnny Lu
• [gmx-users] Gromacs 5.0.1 restart simulation   wh
  • [gmx-users] Gromacs 5.0.1 restart simulation   Mark Abraham
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 10   wh
  • [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 10   Mark Abraham
• [gmx-users] Performance of GPU Workstation (GPU selection)   mail at 2718-mail.de
  • [gmx-users] Performance of GPU Workstation (GPU selection)   Carsten Kutzner
    • [gmx-users] Performance of GPU Workstation (GPU selection)   mail at 2718-mail.de
      • [gmx-users] Performance of GPU Workstation (GPU selection)   Szilárd Páll
• [gmx-users] default state of "energygrps" in .mdp file   Agnivo Gosai
  • [gmx-users] default state of "energygrps" in .mdp file   Justin Lemkul
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 11   wh
  • [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 11   Justin Lemkul
• [gmx-users] merging chains in gromos43a1p   Jayant James
  • [gmx-users] merging chains in gromos43a1p   Justin Lemkul
    • [gmx-users] merging chains in gromos43a1p   Jayant James
      • [gmx-users] merging chains in gromos43a1p   Justin Lemkul
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 12   wh
  • [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 12   Justin Lemkul
• [gmx-users] questions about normal mode analysis in gromacs   凌未风
• [gmx-users] Remove rotation from rmsd   Mikhail Yustanov
  • [gmx-users] Remove rotation from rmsd   Justin Lemkul
• [gmx-users] How can I analyze an interaction between protein and CU ions   Batdorj Batsaikhan
  • [gmx-users] How can I analyze an interaction between protein and CU ions   Batdorj Batsaikhan
• [gmx-users] use of g_hbond   soumadwip ghosh
  • [gmx-users] use of g_hbond   Alexander Law
  • [gmx-users] use of g_hbond   Alexander Law
• [gmx-users] Umbrella Sampling continuation   Alexander Law
• [gmx-users] Errors about dihidral angle type 9 in free energy perturbation   Jianguo Li
  • [gmx-users] Errors about dihidral angle type 9 in free energy perturbation   Justin Lemkul
    • [gmx-users] Errors about dihidral angle type 9 in free energy perturbation   Jianguo Li
      • [gmx-users] Errors about dihidral angle type 9 in free energy perturbation   Justin Lemkul
• [gmx-users] g_spatial   pratibha kapoor
  • [gmx-users] g_spatial   Justin Lemkul
• [gmx-users] energy groups rerun from reduced xtc file   Harry Mark Greenblatt
  • [gmx-users] energy groups rerun from reduced xtc file   Mark Abraham
    • [gmx-users] energy groups rerun from reduced xtc file   Harry Mark Greenblatt
      • [gmx-users] energy groups rerun from reduced xtc file   Mark Abraham
• [gmx-users] g_covar + g_anaeig entropy calculation   Albert
  • [gmx-users] g_covar + g_anaeig entropy calculation   Albert
• [gmx-users] (no subject)   Prajisha Sujaya
  • [gmx-users] (no subject)   Justin Lemkul
• [gmx-users] Umbrella Sampling continuation   Lalita Shaki
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 15   soumadwip ghosh
  • [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 15   Justin Lemkul
• [gmx-users] use of g_hbond   soumadwip ghosh
• [gmx-users] charmm to gromacs   Rebeca García Fandiño
  • [gmx-users] charmm to gromacs   Justin Lemkul
• [gmx-users] biasing potential replica exchang for polymer   leila salimi
• [gmx-users] MDP parameters for OPLS-aa + Verlet cutoff scheme   Jernej Zidar
  • [gmx-users] MDP parameters for OPLS-aa + Verlet cutoff scheme   Justin Lemkul
• [gmx-users] using g_hbond between index gps of specific interest   soumadwip ghosh
  • [gmx-users] using g_hbond between index gps of specific interest   Erik Marklund
• [gmx-users] Regarding parallel run in Gromacs 5.0   Bikash Ranjan Sahoo
  • [gmx-users] Regarding parallel run in Gromacs 5.0   Mark Abraham
    • [gmx-users] Regarding parallel run in Gromacs 5.0   Bikash Ranjan Sahoo
      • [gmx-users] Regarding parallel run in Gromacs 5.0   Mark Abraham
• [gmx-users] adding a new residue into an existing force field?   marzieh dehghan
  • [gmx-users] adding a new residue into an existing force field?   Justin Lemkul
• [gmx-users] multinode issue   Éric Germaneau
  • [gmx-users] multinode issue   Mark Abraham
    • [gmx-users] multinode issue   Éric Germaneau
      • [gmx-users] multinode issue   Mark Abraham
      • [gmx-users] multinode issue   Szilárd Páll
      • [gmx-users] multinode issue   Szilárd Páll
      • [gmx-users] multinode issue   Éric Germaneau
      • [gmx-users] multinode issue   Mark Abraham
      • [gmx-users] multinode issue   Éric Germaneau
• [gmx-users] Regarding Gromacs parallel run   Bikash Ranjan Sahoo
• [gmx-users] Re : using g_hbond between index gps of specific interest   soumadwip ghosh
  • [gmx-users] using g_hbond between index gps of specific interest   Erik Marklund
• [gmx-users] using g_hbond between index gps of specific   soumadwip ghosh
  • [gmx-users] using g_hbond between index gps of specific   Justin Lemkul
• [gmx-users] Simulating Carbon nanotubes as finite systems in GROMACS   Sergio Manzetti
  • [gmx-users] Simulating Carbon nanotubes as finite systems in GROMACS   abhijit Kayal
  • [gmx-users] Simulating Carbon nanotubes as finite systems in GROMACS   Dr. Vitaly Chaban
• [gmx-users] Structure downloads   Norman, Lucy
  • [gmx-users] Structure downloads   Erik Marklund
• [gmx-users] running g_tune_pme on stampede   Kevin Chen
  • [gmx-users] running g_tune_pme on stampede   Mark Abraham
  • [gmx-users] running g_tune_pme on stampede   Carsten Kutzner
• [gmx-users] A small Questions of umbrella samping   vg
  • [gmx-users] A small Questions of umbrella samping   Justin Lemkul
• [gmx-users] how to scale epsilon parameters of Lennard-Jones term in .top file   周双艳
• [gmx-users] Regarding Gromacs 5.0 parallel installation   Bikash Ranjan Sahoo
  • [gmx-users] Regarding Gromacs 5.0 parallel installation   Mark Abraham
• [gmx-users] A small Questions of umbrella samping   vg
  • [gmx-users] A small Questions of umbrella samping   Justin Lemkul
• [gmx-users] Make DNA stay in the center of the box during Simulation   Hovakim Grabski
  • [gmx-users] Make DNA stay in the center of the box during Simulation   Justin Lemkul
• [gmx-users] CNT simulation   Sergio Manzetti
  • [gmx-users] CNT simulation   Sergio Manzetti
• [gmx-users] Отв: Make DNA stay in the center of the box during Simulation   Justin Lemkul
• [gmx-users] Precision of xtc-precision   Johnny Lu
  • [gmx-users] Precision of xtc-precision   Mark Abraham
• [gmx-users] .itp file of choline molecule   soumadwip ghosh
  • [gmx-users] .itp file of choline molecule   Justin Lemkul
• [gmx-users] How to scale epsilon parameters of Lennard-Jones term in .top file?   周双艳
  • [gmx-users] How to scale epsilon parameters of Lennard-Jones term in .top file?   Jianguo Li
• [gmx-users] Problems with CO2-water simulation   sujithkakkat .
  • [gmx-users] Problems with CO2-water simulation   Tsjerk Wassenaar
    • [gmx-users] Problems with CO2-water simulation   sujithkakkat .
      • [gmx-users] Problems with CO2-water simulation   Tsjerk Wassenaar
      • [gmx-users] Problems with CO2-water simulation   sujithkakkat .
      • [gmx-users] Problems with CO2-water simulation   Tsjerk Wassenaar
• [gmx-users] Error in protein insertion in bilipid layer   Priya Das
  • [gmx-users] Error in protein insertion in bilipid layer   Justin Lemkul
    • [gmx-users] Error in protein insertion in bilipid layer   Priya Das
• [gmx-users] running solvate twice...   Harry Mark Greenblatt
  • [gmx-users] running solvate twice...   Justin Lemkul
    • [gmx-users] running solvate twice...   Harry Mark Greenblatt
      • [gmx-users] running solvate twice...   Justin Lemkul
      • [gmx-users] running solvate twice...   Harry Mark Greenblatt
      • [gmx-users] running solvate twice...   Tsjerk Wassenaar
• [gmx-users] Basic GROMACS questions   Simone Bolognini
  • [gmx-users] Basic GROMACS questions   Justin Lemkul
• [gmx-users] slight correction...   Harry Mark Greenblatt
• [gmx-users] .itp file of choline molecule   soumadwip ghosh
  • [gmx-users] .itp file of choline molecule   Justin Lemkul
• [gmx-users] trr file time/frame information   gromacs query
  • [gmx-users] trr file time/frame information   Mark Abraham
    • [gmx-users] trr file time/frame information   gromacs query
      • [gmx-users] trr file time/frame information   Mark Abraham
• [gmx-users] Basic GROMACS questions   Simone Bolognini
  • [gmx-users] Basic GROMACS questions   Justin Lemkul
• [gmx-users] g_wham 4.67 version output query   Agnivo Gosai
• [gmx-users] Question on installation   Igor Shchechkin
  • [gmx-users] Question on installation   Justin Lemkul
    • [gmx-users] Question on installation   Johnny Lu
• [gmx-users] conformational entropy   xy21hb
  • [gmx-users] conformational entropy   Daniel Margul
• [gmx-users] ProDrg   xy21hb
  • [gmx-users] ProDrg   Justin Lemkul
    • [gmx-users] ProDrg   Naba
      • [gmx-users] ProDrg   Hadházi Ádám
  • [gmx-users] ProDrg   Magnus Lundborg
• [gmx-users] protein-ligand complex fatal error   Yaser Hosseini
  • [gmx-users] protein-ligand complex fatal error   Justin Lemkul
• [gmx-users] Basic GROMACS questions   Simone Bolognini
  • [gmx-users] Basic GROMACS questions   Justin Lemkul
• [gmx-users] Problems about the WALL used with NPT systems: possible bug?   xu zhijun
  • [gmx-users] Problems about the WALL used with NPT systems: possible bug?   xu zhijun
• [gmx-users] g_wham 4.6.7 version output query   Agnivo Gosai
  • [gmx-users] g_wham 4.6.7 version output query   Justin Lemkul
• [gmx-users] Problems about the WALL used with NPT systems: possible bug?   xu zhijun
• [gmx-users] Protein distance with respect to box walls   James Lord
  • [gmx-users] Protein distance with respect to box walls   amin at imtech.res.in
    • [gmx-users] Protein distance with respect to box walls   Smith, Micholas D.
      • [gmx-users] Protein distance with respect to box walls   xu zhijun
      • [gmx-users] Protein distance with respect to box walls   Erik Marklund
• [gmx-users] PMF and RDF   sujithkakkat .
  • [gmx-users] PMF and RDF   Erik Marklund
    • [gmx-users] PMF and RDF   Erik Marklund
      • [gmx-users] PMF and RDF   sujithkakkat .
      • [gmx-users] PMF and RDF   Justin Lemkul
  • [gmx-users] PMF and RDF   Justin Lemkul
• [gmx-users] Free energy calculation by MM_PBSA   Indu Kumari
  • [gmx-users] Free energy calculation by MM_PBSA   Bikash Ranjan Sahoo
    • [gmx-users] Free energy calculation by MM_PBSA   Indu Kumari
      • [gmx-users] Free energy calculation by MM_PBSA   Indu Kumari
• [gmx-users] Empirical force fields: release of R.E.D. Server Dev./PyRED Nov. 2014   FyD
• [gmx-users] problem during energy minimization   soumadwip ghosh
  • [gmx-users] problem during energy minimization   Justin Lemkul
• [gmx-users] Gromacs 5.0.3 released   Mark Abraham
• [gmx-users] Dihedral angle calculation in Gromacs   Johnny Lu
• [gmx-users] Your solvent group size (*) is not a multiple of *   Hassan Aaryapour
  • [gmx-users] Your solvent group size (*) is not a multiple of *   Justin Lemkul
• [gmx-users] Possible bugs: Problems about the 12-6 WALL used with NPT systems.   xu zhijun
• [gmx-users] gromacs on GPU   Shaohao Chen
  • [gmx-users] gromacs on GPU   Szilárd Páll
    • [gmx-users] gromacs on GPU   Shaohao Chen
• [gmx-users] Regarding Gromacs 5.0.3 parallel computation   Bikash Ranjan Sahoo
  • [gmx-users] Regarding Gromacs 5.0.3 parallel computation   Téletchéa Stéphane
    • [gmx-users] Regarding Gromacs 5.0.3 parallel computation   Bikash Ranjan Sahoo
      • [gmx-users] Regarding Gromacs 5.0.3 parallel computation   Téletchéa Stéphane
• [gmx-users] Installation problem with Gromacs 5.0.2   PAULAMI CHATTERJEE
  • [gmx-users] Installation problem with Gromacs 5.0.2   Bikash Ranjan Sahoo
    • [gmx-users] Installation problem with Gromacs 5.0.2   PAULAMI CHATTERJEE
      • [gmx-users] Installation problem with Gromacs 5.0.2   Mark Abraham
• [gmx-users] Regarding the generation of intermolecule disulphide bond between two monomer subunits   bipin singh
  • [gmx-users] Regarding the generation of intermolecule disulphide bond between two monomer subunits   Justin Lemkul
    • [gmx-users] Regarding the generation of intermolecule disulphide bond between two monomer subunits   bipin singh
• [gmx-users] Problem with gmx-users mail list subscription   Elena Lilkova
• [gmx-users] Morse potential for Specific Group   Jackson Chief Elk
  • [gmx-users] Morse potential for Specific Group   Mark Abraham
  • [gmx-users] Morse potential for Specific Group   Bogdan Costescu
• [gmx-users] how to scale epsilon parameters of Lennard-Jones term in .top file   Shuangyan Zhou
• [gmx-users] use of g_densmap   soumadwip ghosh
• [gmx-users] Can I use gromos43a1p-4.5.1.tar.gz in gromacs5.0?   Batdorj Batsaikhan
• [gmx-users] Segmentation fault error   Seyed Mojtaba Rezaei Sani
• [gmx-users] Maximun time-step recommended in the grompp part for each system   Mario Fernández Pendás
  • [gmx-users] Maximun time-step recommended in the grompp part for each system   Mario Fernández Pendás
    • [gmx-users] Maximun time-step recommended in the grompp part for each system   Justin Lemkul
      • [gmx-users] Maximun time-step recommended in the grompp part for each system   Mario Fernández Pendás
      • [gmx-users] Maximun time-step recommended in the grompp part for each system   Justin Lemkul
      • [gmx-users] Maximun time-step recommended in the grompp part for each system   Mario Fernández Pendás
• [gmx-users] xeon-phi and double precision   Johnny Lu
  • [gmx-users] xeon-phi and double precision   Mark Abraham
• [gmx-users] Segmentation fault error   Seyed Mojtaba Rezaei Sani
  • [gmx-users] Segmentation fault error   Mark Abraham
    • [gmx-users] Segmentation fault error   Seyed Mojtaba Rezaei Sani
      • [gmx-users] Segmentation fault error   Mark Abraham
• [gmx-users] Using g_densmap   soumadwip ghosh
• [gmx-users] How to define the covalent bonds between ligand and protein   Bikash Ranjan Sahoo
• [gmx-users] Fwd: Question about GPU acceleration in GROMACS 5   Tomy van Batis
  • [gmx-users] Fwd: Question about GPU acceleration in GROMACS 5   Mark Abraham
  • [gmx-users] Question about GPU acceleration in GROMACS 5   Tomy van Batis
    • [gmx-users] Question about GPU acceleration in GROMACS 5   Carsten Kutzner
    • [gmx-users] Question about GPU acceleration in GROMACS 5   Mark Abraham
      • [gmx-users] Question about GPU acceleration in GROMACS 5   Tomy van Batis
• [gmx-users] protein-ligand complex fatal error   Yaser Hosseini
  • [gmx-users] protein-ligand complex fatal error   Justin Lemkul
• [gmx-users] trjconv precision lost from double to single conversion   Johnny Lu
  • [gmx-users] trjconv precision lost from double to single conversion   Johnny Lu
    • [gmx-users] trjconv precision lost from double to single conversion   Johnny Lu
  • [gmx-users] trjconv precision lost from double to single conversion   Mark Abraham
• [gmx-users] pmetune and restarting   Johnny Lu
  • [gmx-users] pmetune and restarting   Mark Abraham
• [gmx-users] with 5.0: file INSTALL cannot find gmx   Jochen Hub
  • [gmx-users] with 5.0: file INSTALL cannot find gmx   Johnny Lu
    • [gmx-users] with 5.0: file INSTALL cannot find gmx   Mark Abraham
      • [gmx-users] with 5.0: file INSTALL cannot find gmx   Jochen Hub
      • [gmx-users] with 5.0: file INSTALL cannot find gmx   Jochen Hub
      • [gmx-users] with 5.0: file INSTALL cannot find gmx   Johnny Lu
      • [gmx-users] with 5.0: file INSTALL cannot find gmx   Johnny Lu
      • [gmx-users] with 5.0: file INSTALL cannot find gmx   Jochen Hub
• [gmx-users] pdb2gmx atom not found   xy21hb
  • [gmx-users] pdb2gmx atom not found   Justin Lemkul
• [gmx-users] Segfault on energy minimization   Diego Muñoz G.
  • [gmx-users] Segfault on energy minimization   Mark Abraham
    • [gmx-users] Segfault on energy minimization   Diego Muñoz G.
• [gmx-users] Fw: pdb2gmx atom not found   xy21hb
• [gmx-users] output dispersion correction and coul. recip. for energy groups   Yongchul Chung
  • [gmx-users] output dispersion correction and coul. recip. for energy groups   Mark Abraham
    • [gmx-users] output dispersion correction and coul. recip. for energy groups   Yongchul Chung
      • [gmx-users] output dispersion correction and coul. recip. for energy groups   Mark Abraham
• [gmx-users] adding hydrogen atoms into a POPC membrane   Carlos Navarro Retamal
  • [gmx-users] adding hydrogen atoms into a POPC membrane   Justin Lemkul
    • [gmx-users] adding hydrogen atoms into a POPC membrane   Tsjerk Wassenaar
      • [gmx-users] adding hydrogen atoms into a POPC membrane   Carlos Navarro Retamal
      • [gmx-users] adding hydrogen atoms into a POPC membrane   Carlos Navarro Retamal
      • [gmx-users] adding hydrogen atoms into a POPC membrane   Thomas Piggot
• [gmx-users] Stop protein diffusion in simulation box to make a movie   Hassan Aaryapour
  • [gmx-users] Stop protein diffusion in simulation box to make a movie   Johnny Lu
  • [gmx-users] Stop protein diffusion in simulation box to make a movie   Justin Lemkul
• [gmx-users] Need to Sort Out   Devender Arora
  • [gmx-users] Need to Sort Out   Johnny Lu
  • [gmx-users] Need to Sort Out   Justin Lemkul
• [gmx-users] Is the discontinuity in type 2 improper dihedrals at 90 deg. or 180 deg. ?   Christopher Neale
  • [gmx-users] Is the discontinuity in type 2 improper dihedrals at 90 deg. or 180 deg. ?   Justin Lemkul
• [gmx-users] content of trr / xtc files + -b/-e flag question + tpr question   Eric Smoll
  • [gmx-users] content of trr / xtc files + -b/-e flag question + tpr question   Mark Abraham
• [gmx-users] Problems with CO2-water simulation   sujithkakkat .
  • [gmx-users] Problems with CO2-water simulation   David van der Spoel
• [gmx-users] mdp file coarse grained simulation with cutoff-scheme =?utf-8?Q?=3D_?=Verlet   Carlos Navarro Retamal
  • [gmx-users] mdp file coarse grained simulation with cutoff-scheme = Verlet   Mark Abraham
    • [gmx-users] mdp file coarse grained simulation with cutoff-scheme =?utf-8?Q?=3D_?=Verlet   Carlos Navarro Retamal
      • [gmx-users] mdp file coarse grained simulation with cutoff-scheme = Verlet   Mark Abraham
• [gmx-users] trjconv during transfer of .trr   Johnny Lu
  • [gmx-users] trjconv during transfer of .trr   Johnny Lu
    • [gmx-users] trjconv during transfer of .trr   Johnny Lu
      • [gmx-users] trjconv during transfer of .trr   Eric Smoll
• [gmx-users] Walls and pressure coupling   Jingjie
• [gmx-users] Is the discontinuity in type 2 improper dihedrals at 90 deg. or 180 deg. ?   Christopher Neale
• [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Jason Hill
  • [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Carsten Kutzner
    • [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Szilárd Páll
• [gmx-users] avx2 with gcc 4.8.3   Harry Mark Greenblatt
  • [gmx-users] avx2 with gcc 4.8.3   Mark Abraham
    • [gmx-users] avx2 with gcc 4.8.3   Harry Mark Greenblatt
• [gmx-users] can you please add my email to the mailing list?   Vered Kunik
• [gmx-users] gromacs workshop in Europe during 2015   Vered Kunik
• [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Jason Hill
• [gmx-users] 0 +- 0.5 bar ok?   Johnny Lu
  • [gmx-users] 0 +- 0.5 bar ok?   Justin Lemkul
• [gmx-users] Gromacs 5.0.4 released   Mark Abraham
• [gmx-users] parametrization of GABA for charmm27   jkrieger at mrc-lmb.cam.ac.uk
  • [gmx-users] parametrization of GABA for charmm27   Justin Lemkul
• [gmx-users] avx2 with gcc 4.8.3   Roland Schulz
  • [gmx-users] avx2 with gcc 4.8.3   Harry Mark Greenblatt
    • [gmx-users] avx2 with gcc 4.8.3   Mark Abraham
      • [gmx-users] avx2 with gcc 4.8.3   Harry Mark Greenblatt
• [gmx-users] Ions drifting   jani vinod
  • [gmx-users] Ions drifting   Justin Lemkul
    • [gmx-users] Ions drifting   jani vinod
      • [gmx-users] Ions drifting   Johnny Lu
      • [gmx-users] Ions drifting   jani vinod
      • [gmx-users] Ions drifting   Justin Lemkul
      • [gmx-users] Ions drifting   jani vinod
      • [gmx-users] Ions drifting   Johnny Lu
      • [gmx-users] Ions drifting   Johnny Lu
      • [gmx-users] Ions drifting   jani vinod
      • [gmx-users] Ions drifting   Justin Lemkul
      • [gmx-users] Ions drifting   Johnny Lu
      • [gmx-users] Ions drifting   jani vinod
      • [gmx-users] Ions drifting   Tsjerk Wassenaar
      • [gmx-users] Ions drifting   jani vinod
• [gmx-users] Steered molecular dynamics   Priya Das
  • [gmx-users] Steered molecular dynamics   Erik Marklund
• [gmx-users] GXT690 vs GTX Titan black   Albert
  • [gmx-users] GXT690 vs GTX Titan black   Mirco Wahab
    • [gmx-users] GXT690 vs GTX Titan black   Albert
      • [gmx-users] GXT690 vs GTX Titan black   Szilárd Páll
      • [gmx-users] GXT690 vs GTX Titan black   Carsten Kutzner
      • [gmx-users] GXT690 vs GTX Titan black   Albert
      • [gmx-users] GXT690 vs GTX Titan black   Mirco Wahab
      • [gmx-users] GXT690 vs GTX Titan black   Szilárd Páll
• [gmx-users] Add new residue to forcefield   fatemeh ramezani
  • [gmx-users] Add new residue to forcefield   Justin Lemkul
• [gmx-users] send this as a post   Abid Channa
• [gmx-users] Converting Amber parameters to gromacs parameters   Carlos Navarro Retamal
  • [gmx-users] Converting Amber parameters to gromacs parameters   Magnus Lundborg
    • [gmx-users] Converting Amber parameters to gromacs parameters   Alan
• [gmx-users] g_hbond not running   antoni borysik
  • [gmx-users] g_hbond not running   Erik Marklund
    • [gmx-users] g_hbond not running   antoni borysik
      • [gmx-users] g_hbond not running   Erik Marklund
      • [gmx-users] g_hbond not running   antoni borysik
      • [gmx-users] g_hbond not running   Erik Marklund
• [gmx-users] Renumber atom ids and charge group in topology (.itp)   Nash, Anthony
  • [gmx-users] Renumber atom ids and charge group in topology (.itp)   Justin Lemkul
    • [gmx-users] Renumber atom ids and charge group in topology (.itp)   Nash, Anthony
      • [gmx-users] Renumber atom ids and charge group in topology (.itp)   Justin Lemkul
      • [gmx-users] Renumber atom ids and charge group in topology (.itp)   Nash, Anthony
• [gmx-users] 5.0.4 Compilation - SelectionUnitTests Failed   Mike Hanby
  • [gmx-users] 5.0.4 Compilation - SelectionUnitTests Failed   Johnny Lu
    • [gmx-users] 5.0.4 Compilation - SelectionUnitTests Failed   Johnny Lu
• [gmx-users] 5.0.4 Compilation - SelectionUnitTests Failed   Roland Schulz
  • [gmx-users] 5.0.4 Compilation - SelectionUnitTests Failed   Mike Hanby
• [gmx-users] Question about water freezing when in contact to a solid surface   ramon
• [gmx-users] Silica monolayer with Martini force field   André Farias de Moura
• [gmx-users] fatal erroe in prorein-ligand comlex   Yaser Hosseini
  • [gmx-users] fatal erroe in prorein-ligand comlex   Justin Lemkul
    • [gmx-users] fatal erroe in prorein-ligand comlex   Justin Lemkul
  • [gmx-users] fatal erroe in prorein-ligand comlex   Bikash Ranjan Sahoo
    • [gmx-users] fatal erroe in prorein-ligand comlex   Justin Lemkul
• [gmx-users] GTX 980 benchmark   Hadházi Ádám
  • [gmx-users] GTX 980 benchmark   Szilárd Páll
    • [gmx-users] GTX 980 benchmark   Johnny Lu
      • [gmx-users] GTX 980 benchmark   Szilárd Páll
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 74   Abid Channa
  • [gmx-users] fatal erroe in prorein-ligand comlex   Justin Lemkul
• [gmx-users] Force Field for protein in water   neha bharti
  • [gmx-users] Force Field for protein in water   Justin Lemkul
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 74   Yaser Hosseini
  • [gmx-users] fatal erroe in prorein-ligand comlex   Justin Lemkul
• [gmx-users] Fw: Add new residue to oplsaa force field   fatemeh ramezani
  • [gmx-users] Fw: Add new residue to oplsaa force field   Justin Lemkul
• [gmx-users] how to decouple a solute (a) only from itself and not the solvent, and (b) leaving the LJ repulsive term unmodified   Christopher Neale
  • [gmx-users] how to decouple a solute (a) only from itself and not the solvent, and (b) leaving the LJ repulsive term unmodified   Justin Lemkul
    • [gmx-users] how to decouple a solute (a) only from itself and not the solvent, and (b) leaving the LJ repulsive term unmodified   Christopher Neale
• [gmx-users] Force between two groups of atoms   ibrahim khalil
• [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Jason Hill
  • [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Szilárd Páll
    • [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Albert
• [gmx-users] compiling for xeon phi   Johnny Lu
• [gmx-users] Amber missing psi dihedral at cationic N-terminus of protein/peptide?   Christopher Neale
• [gmx-users] g_mindist   James Lord
  • [gmx-users] g_mindist   Erik Marklund
• [gmx-users] CG MD Simulation of DNA and PAMAM dendrimers   Doa Hawamdeh
  • [gmx-users] CG MD Simulation of DNA and PAMAM dendrimers   Johnny Lu
• [gmx-users] PTM force field   Jianqing Xu
  • [gmx-users] PTM force field   Justin Lemkul
    • [gmx-users] PTM force field   Jianqing Xu
      • [gmx-users] PTM force field   Justin Lemkul
      • [gmx-users] PTM force field   Jianqing Xu
• [gmx-users] Add new residue to oplsaa force field   fatemeh ramezani
  • [gmx-users] Add new residue to oplsaa force field   Justin Lemkul
• [gmx-users] Pressure in gromacs   Sushma Yadav
• [gmx-users] Xeon Phi benchmark?   Albert
• [gmx-users] AMD GPUs   Szilárd Páll
  • [gmx-users] AMD GPUs   Johnny Lu
    • [gmx-users] AMD GPUs   Szilárd Páll
      • [gmx-users] AMD GPUs   mail at 2718-mail.de
      • [gmx-users] AMD GPUs   Mark Abraham
• [gmx-users] How to change the multiplicity of a dihedral in FEP in Gromacs   bipin singh
  • [gmx-users] How to change the multiplicity of a dihedral in FEP in Gromacs   Christopher Neale
• [gmx-users] Mplecular Dynamic simulation of DNA and PAMAM dendrimers   Doa Hawamdeh
• [gmx-users] Problem Simulating a protein with small peptides   Arash Firouzbakht
  • [gmx-users] Problem Simulating a protein with small peptides   Justin Lemkul
• [gmx-users] martinize.py: option for partly have elastic network on partly in the protein   shivangi nangia
  • [gmx-users] martinize.py: option for partly have elastic network on partly in the protein   XAvier Periole
• [gmx-users] how can i use acpype   Yaser Hosseini
  • [gmx-users] how can i use acpype   Justin Lemkul
• [gmx-users] Working on a GPU cluster with GROMACS 5   Ebert Maximilian
  • [gmx-users] Working on a GPU cluster with GROMACS 5   Carsten Kutzner
• [gmx-users] Preparing a silicon bulk   Kevin C Chan
  • [gmx-users] Preparing a silicon bulk   Justin Lemkul
• [gmx-users] Preparing a silicon bulk   Kevin C Chan
  • [gmx-users] Preparing a silicon bulk   Justin Lemkul
• [gmx-users] Atomtype ZN2+ not found   Shankar Prasad Kanaujia
  • [gmx-users] Atomtype ZN2+ not found   Justin Lemkul
    • [gmx-users] Atomtype ZN2+ not found   Shankar Prasad Kanaujia
• [gmx-users] BN parameters in MD   Kester Wong
• [gmx-users] Query regarding ligand topology   Priya Das
  • [gmx-users] Query regarding ligand topology   Justin Lemkul
• [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Jason Hill
  • [gmx-users] Trouble balancing GPU/CPU force calculation load, ratio = 0.09   Szilárd Páll
• [gmx-users] Question about water freezing when in contact to a solid surface (ramon)   ramon
  • [gmx-users] Question about water freezing when in contact to a solid surface (ramon)   André Farias de Moura
    • [gmx-users] Question about water freezing when in contact to a solid surface (ramon)   Tsjerk Wassenaar
• [gmx-users] Preparing a silicon bulk   Kevin C Chan
  • [gmx-users] Preparing a silicon bulk   Justin Lemkul
• [gmx-users] Naughty Vacuum Bubble in our Vesicle!   Björn Sommer
• [gmx-users] Element naming format in .pdb file   Rajan Kumar
  • [gmx-users] Element naming format in .pdb file   Johnny Lu
  • [gmx-users] Element naming format in .pdb file   Justin Lemkul
• [gmx-users] Pressure in gromacs   Narendra Kumar
• [gmx-users] Non-bonded interactions   Doa Hawamdeh
  • [gmx-users] Non-bonded interactions   Justin Lemkul
• [gmx-users] Preparing a silicon bulk   Kevin C Chan
  • [gmx-users] Preparing a silicon bulk   Justin Lemkul
    • [gmx-users] Preparing a silicon bulk   Kevin C Chan
      • [gmx-users] Preparing a silicon bulk   Justin Lemkul
• [gmx-users] Postdoctoral position at the KAUST   Luigi Cavallo
• [gmx-users] a question about Electric fields   BIRD
• [gmx-users] (no subject)   Doa Hawamdeh
  • [gmx-users] (no subject)   Mark Abraham
• [gmx-users] PCA of crystal structures   neeru sharma
  • [gmx-users] PCA of crystal structures   Ullmann, Thomas
• [gmx-users] fluid flow   Katie Maerzke
• [gmx-users] minimal distance between periodic images   jinxin
  • [gmx-users] minimal distance between periodic images   Tsjerk Wassenaar
• [gmx-users] Regarding Null free energy values in Free energy perturbation (bond force constant perturbation)   bipin singh
• [gmx-users] qm-mm calculation : Gromacs + cpmd   Nilesh Dhumal
• [gmx-users] Installing GTX 980 on linux - which distro should i use?   Carlos Navarro Retamal
  • [gmx-users] Installing GTX 980 on linux - which distro should i use?   Carsten Kutzner
    • [gmx-users] Installing GTX 980 on linux - which distro should i use?   Mark Abraham
      • [gmx-users] Installing GTX 980 on linux - which distro should i se?   Carlos Navarro Retamal
  • [gmx-users] Installing GTX 980 on linux - which distro should i use?   Mohammad Hossein Borghei
  • [gmx-users] Installing GTX 980 on linux - which distro should i use?   Téletchéa Stéphane
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 97   jinxin
• [gmx-users] Illegal instruction flag raised in GMX 5.0.4   Jayant James
  • [gmx-users] Illegal instruction flag raised in GMX 5.0.4   Harry Mark Greenblatt
    • [gmx-users] Illegal instruction flag raised in GMX 5.0.4   Carsten Kutzner
      • [gmx-users] Illegal instruction flag raised in GMX 5.0.4   Mark Abraham
• [gmx-users] malloc error at mdrun step   Kalyan Reddy
• [gmx-users] Implicit and explicit solvation   neha bharti
  • [gmx-users] Implicit and explicit solvation   Erik Marklund
• [gmx-users] Protein split with mindist   Tsjerk Wassenaar
• [gmx-users] calculation of H-bonds   soumadwip ghosh
• [gmx-users] Error in topology using g_x2top   Rajan Kumar
  • [gmx-users] Error in topology using g_x2top   Justin Lemkul
• [gmx-users] Pulling code   asasa qsqs
• [gmx-users] gmxcheck : Magic Number Error in XTC file (read 0, should be 1995)   Amit Kumawat
  • [gmx-users] gmxcheck : Magic Number Error in XTC file (read 0, should be 1995)   David van der Spoel
    • [gmx-users] gmxcheck : Magic Number Error in XTC file (read 0, should be 1995)   Amit Kumawat
      • [gmx-users] gmxcheck : Magic Number Error in XTC file (read 0, should be 1995)   Chandan Choudhury
      • [gmx-users] gmxcheck : Magic Number Error in XTC file (read 0, should be 1995)   Amit Kumawat
      • [gmx-users] gmxcheck : Magic Number Error in XTC file (read 0, should be 1995)   Mark Abraham
• [gmx-users] initial velocities   mah maz
  • [gmx-users] initial velocities   Tsjerk Wassenaar
  • [gmx-users] initial velocities   mah maz
    • [gmx-users] initial velocities   Tsjerk Wassenaar
      • [gmx-users] initial velocities   Justin Lemkul
    • [gmx-users] initial velocities   mah maz
• [gmx-users] Pulling code   asasa qsqs
• [gmx-users] length of beta sheet   pratibha kapoor
  • [gmx-users] length of beta sheet   Justin Lemkul
• [gmx-users] Questions about CO2.   sujithkakkat .
  • [gmx-users] Questions about CO2.   David van der Spoel
  • [gmx-users] Umbrella sampling along a dihedral angle   Nash, Anthony
    • [gmx-users] Umbrella sampling along a dihedral angle   Justin Lemkul
      • [gmx-users] Umbrella sampling along a dihedral angle   Nash, Anthony
      • [gmx-users] Umbrella sampling along a dihedral angle   Nash, Anthony
      • [gmx-users] Umbrella sampling along a dihedral angle   Justin Lemkul
      • [gmx-users] Umbrella sampling along a dihedral angle   Nash, Anthony
• [gmx-users] Pulling   asasa qsqs
  • [gmx-users] Pulling   Justin Lemkul
• [gmx-users] dangling bond error no matter what pdb file I use   asasa qsqs
• [gmx-users] How to choose the best pose of ligand from the trajectory file?   Hassan Aaryapour
  • [gmx-users] How to choose the best pose of ligand from the trajectory file?   Justin Lemkul
• [gmx-users] how to use gmx convert-tpr for GMX5.0.4   Smart Eagle
• [gmx-users] How to use gmx convert-tpr for GMX5.0.4   Smart Eagle
  • [gmx-users] How to use gmx convert-tpr for GMX5.0.4   Mark Abraham
• [gmx-users] extracting velocities   mah maz
  • [gmx-users] extracting velocities   Tsjerk Wassenaar
  • [gmx-users] extracting velocities   mah maz
    • [gmx-users] extracting velocities   Tsjerk Wassenaar
    • [gmx-users] extracting velocities   mah maz
• [gmx-users] MMPBSA & GMXPBSA 2.1   Tom
  • [gmx-users] MMPBSA & GMXPBSA 2.1   andrea spitaleri
• [gmx-users] conversion of amber outputs to gromacs   shahab shariati
• [gmx-users] How to plot a droplet radius profile as a function of z-direction?   Kester Wong
  • [gmx-users] How to plot a droplet radius profile as a function of z-direction?   Justin Lemkul
• [gmx-users] RDF calculation.   soumadwip ghosh
  • [gmx-users] RDF calculation.   Marcelo Depólo
  • [gmx-users] RDF calculation.   Justin Lemkul
• [gmx-users] core dumped   elham tazikeh
  • [gmx-users] core dumped   Justin Lemkul
• [gmx-users] Error during entropy calculation   bipin singh
• [gmx-users] charge distribution   elham tazikeh
  • [gmx-users] charge distribution   Justin Lemkul
• [gmx-users] core dumped   elham tazikeh
  • [gmx-users] core dumped   Justin Lemkul
• [gmx-users] Fatal error during entropy calculation using g_anaeig   bipin singh
• [gmx-users] charge distribution   elham tazikeh
  • [gmx-users] charge distribution   Justin Lemkul
• [gmx-users] how to remove water molecule inside micelle?   Mina Hashemi
  • [gmx-users] how to remove water molecule inside micelle?   André Farias de Moura
• [gmx-users] farticle demanding about Small-Molecule Topologies   elham tazikeh
  • [gmx-users] farticle demanding about Small-Molecule Topologies   Justin Lemkul
• [gmx-users] how to remove water molecule inside micelle   ABEL Stephane 175950
• [gmx-users] -vsite hydrogen   h.alizadeh at znu.ac.ir
  • [gmx-users] -vsite hydrogen   Justin Lemkul
• [gmx-users] Obtaining PMF for change in domain position   Abhi Acharya
  • [gmx-users] Obtaining PMF for change in domain position   Justin Lemkul
    • [gmx-users] Obtaining PMF for change in domain position   Abhi Acharya
      • [gmx-users] Obtaining PMF for change in domain position   Justin Lemkul
      • [gmx-users] Obtaining PMF for change in domain position   Abhi Acharya
• [gmx-users] pdb information   elham tazikeh
  • [gmx-users] pdb information   Justin Lemkul
• [gmx-users] Gromacs error regarding default gromos bond type and angle type   Negar Parvizi
  • [gmx-users] Fw: Gromacs error regarding default gromos bond type and angle type   Negar Parvizi
• [gmx-users] -vsite hydrogen   Wojciech Kopeć
• [gmx-users] charge distribution   elham tazikeh
  • [gmx-users] charge distribution   Justin Lemkul
• [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
  • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
    • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Albert
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Albert
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Justin Lemkul
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Justin Lemkul
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Carlos Navarro Retamal
      • [gmx-users] low performance 2 GTX 980+ Intel CPU Core i7-5930K 3.5 GHz (2011-3)   Justin Lemkul
• [gmx-users] RDF does not reach 1 for bulk   Venkat Reddy
• [gmx-users] pdb information   elham tazikeh
  • [gmx-users] pdb information   Justin Lemkul
• [gmx-users] box siz   mah maz
  • [gmx-users] box siz   Justin Lemkul
  • [gmx-users] box siz   mah maz
    • [gmx-users] box siz   Justin Lemkul
    • [gmx-users] box siz   mah maz
• [gmx-users] gromacs.org_gmx-users Digest, Vol 128, Issue 91   Jason Hill
• [gmx-users] Projection of trajectory onto PCs   tarak karmakar
  • [gmx-users] Projection of trajectory onto PCs   Tsjerk Wassenaar
• [gmx-users] All-atom vs United-atom force fields and hydrogen bonds   Jason Hill
  • [gmx-users] All-atom vs United-atom force fields and hydrogen bonds   Justin Lemkul
    • [gmx-users] All-atom vs United-atom force fields and hydrogen bonds   Smith, Micholas D.
• [gmx-users] Define a new group for protein-ligand system   Shima Arasteh
  • [gmx-users] Fwd: Define a new group for protein-ligand system   Shima Arasteh
    • [gmx-users] Jump in temperature each time a new simulation is started.   Dan Sponseller
      • [gmx-users] Jump in temperature each time a new simulation is started.   Justin Lemkul
• [gmx-users] charge distriburion   elham tazikeh
  • [gmx-users] charge distriburion   Justin Lemkul
• [gmx-users] How to plot a droplet radius profile as a function of z-directio   Kester Wong
  • [gmx-users] How to plot a droplet radius profile as a function of z-directio   Justin Lemkul
• [gmx-users] Define a new group for protein-ligand complex system   Shima Arasteh
  • [gmx-users] Define a new group for protein-ligand complex system   Justin Lemkul
• [gmx-users] error while executing do_dssp program   Nizar Masbukhin
  • [gmx-users] error while executing do_dssp program   Justin Lemkul
    • [gmx-users] error while executing do_dssp program   Nizar Masbukhin
      • [gmx-users] error while executing do_dssp program   Justin Lemkul

Last message date: Wed Dec 31 21:08:30 CET 2014
Archived on: Wed Dec 31 21:08:32 CET 2014

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