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How to use the forum
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1
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3544
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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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1963
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April 24, 2020
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CG Simulation error
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0
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5
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December 6, 2024
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Simple energy minimization of a PDB file, is that right?
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8
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9
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December 5, 2024
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Gromacs Version
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3
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465
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December 5, 2024
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Energy minimization error
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9
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10460
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December 5, 2024
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ATP CG-AA backmapping
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0
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7
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December 5, 2024
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Escape prime (') char in atom name for selection command
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3
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28
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December 5, 2024
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Error in running CG commands
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0
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5
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December 5, 2024
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CGenFF ERROR - attype warning: unknown sulfur type (SD) not supported; skipped molecule
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2
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12
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December 5, 2024
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Error about umbrella sampling(pulling simulation)
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1
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5
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December 5, 2024
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Cannot figure out why gmx_mpi cannot detect nvidia GPU
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9
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59
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December 5, 2024
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Abrupt temperature change during heating
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1
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7
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December 5, 2024
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Gmx sasa throwing warning
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1
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9
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December 5, 2024
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Potential issue in gmx genion with -neutral Option for +2 Ions
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2
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6
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December 4, 2024
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How to insert different molecules into system?
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7
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36
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December 4, 2024
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Are the PCA matrices in GROMACS normalized to the same range? That is, are they comparable?
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0
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7
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December 4, 2024
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NPT Equilibration in slab geometry
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3
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15
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December 4, 2024
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Segmentation fault during production run
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4
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20
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December 4, 2024
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Gmx energy for solubility parameter
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1
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12
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December 4, 2024
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Error in Restraining the Ligand
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4
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6
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December 4, 2024
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Umberlla sampling for protein ligand complex
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27
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60
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December 4, 2024
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Issue in generating topology files for protein with GDP residue
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0
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7
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December 4, 2024
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Error in topol.top and sol.gro files
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3
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14
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December 3, 2024
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Issue with dimer MD with gmx editconf -translate
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5
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12
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December 3, 2024
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Why deformation simulation produce Young's modulus significantly different from experimental value?
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8
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29
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December 3, 2024
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Gromacs errors for terminal group selction
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1
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9
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December 3, 2024
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Issue in Generating topology file
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3
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13
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December 3, 2024
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Mm/pbsa and mm/gbsa
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0
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11
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December 3, 2024
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Minimization and Production Errors - Bonds Rotated More than 30 Degrees
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1
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6
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December 3, 2024
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