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How to use the forum
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1
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4067
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October 28, 2020
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About the User discussions category
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0
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2095
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April 24, 2020
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Problem installing gmxapi on Ubuntu
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4
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35
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March 12, 2026
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Viscosity of a liquid from deform
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17
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250
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March 11, 2026
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Gmx cluster and ions
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0
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10
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March 11, 2026
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Energy grps splitting to calculate interaction energy of single water
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1
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15
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March 11, 2026
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Huge conserved energy drifts CG simulation
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3
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247
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March 11, 2026
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Flat-bottom restraints on specific atoms
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3
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9
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March 10, 2026
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Ionic liquid vacuum space in NPT
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0
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7
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March 10, 2026
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[umbrella sampling] Can I use "pull_coord1_geometry = direction" for complexes with cyclodextrins?
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1
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14
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March 9, 2026
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Pdb2gmx says a H is missing from the rtp entry but is not present in pdb
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0
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9
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March 9, 2026
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Problem regarding npt of coarse grained model of Bedaquilline
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0
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3
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March 9, 2026
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Steered Molecular dynamics of a ligand moving towards bilayer membrane
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0
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12
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March 7, 2026
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Velocity generation for each window in umbrella sampling simulations
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2
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17
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March 7, 2026
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Hydrogen mass repartitioning + multiple time step
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2
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23
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March 7, 2026
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Restart MD run from a particular time moment in *.xtc file?
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5
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28
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March 6, 2026
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ERROR 1 rvdw-switch must be < rvdw INQUIRY?
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4
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18
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March 5, 2026
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Diffusion coefficient of molecules
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2
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22
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March 5, 2026
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Which kations you use to neutralize your system in GROMACS (Na+ or K+)?
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3
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302
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March 5, 2026
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User-defined potential for position restraints
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5
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661
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March 4, 2026
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How to fix this?
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3
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24
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March 4, 2026
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Peptide membrane simulation
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6
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97
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March 4, 2026
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Pathogen membrane and peptides simulation
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1
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37
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March 4, 2026
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Segmentation fault - pairdist
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0
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15
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March 3, 2026
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[ angle_restraints_z ]
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0
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6
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March 3, 2026
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Multiple Peptide-Lipid Bilayer Simulations
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1
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299
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March 3, 2026
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How to visualize the histogram created by WHAM tool
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3
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574
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March 3, 2026
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Necessary files to be kept for WHAM analysis?
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3
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20
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March 3, 2026
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Changing the group name in gmx make_ndx
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1
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16
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March 3, 2026
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How to plot viscosity in xmgrace by gmx tcaf
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2
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11
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March 3, 2026
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