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How to use the forum
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0
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4200
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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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2131
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April 24, 2020
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Hamiltonian replica exchange error
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1
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15
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August 28, 2026
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Using GROMACS and PLUMED to do a metadynamics simulations
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0
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11
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August 28, 2026
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NPγT vs NPT for Unrestrained Membrane Equilibration Using the CHARMM36 Force Field
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10
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122
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August 26, 2026
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How to add salt？
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2
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81
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August 26, 2026
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Subject: How to calculate protein spreading area on a membrane over time using GROMACS and Martini 3
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0
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16
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August 26, 2026
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SALADCLOUD Gromacs minimization error Inquiry?
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2
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25
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August 26, 2026
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Results differs in different versions
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2
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30
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August 25, 2026
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Wrapping Inquiry
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4
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68
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August 24, 2026
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MDrun: Simulation speed jumping a factor of 10 with a gpu executable
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6
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69
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August 24, 2026
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Removal of Tabulated Potentials from GROMACS 2020
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2
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651
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August 24, 2026
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Query on electrostatic treatment for slab/interface systems (2D periodicity)
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1
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21
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August 24, 2026
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Loss of performance in v. 2021
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27
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1871
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August 24, 2026
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CUDA illegal memory access during NPT equilibration
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9
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84
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August 21, 2026
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Port LignAmb25 Force Field to GROMACS
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2
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82
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August 19, 2026
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Running gmx_mmpbsa for protein receptor - homodimer protein complex
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0
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46
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August 18, 2026
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Gromacs for Windows on Arm Architecture for Copilot+PC
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3
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65
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August 18, 2026
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How to use machine learning potential trained by deepmd-kit in Gromacs?
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1
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59
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August 17, 2026
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Segmentation fault during slow SMD pulling through a constricted pore
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7
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77
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August 12, 2026
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PBC-related jumps in protein–protein contact analysis of a Martini CG simulation
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0
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35
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August 12, 2026
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Topology and force-field parameters for Rhodamine B in water
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0
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38
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August 10, 2026
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Use of the CRYST1 values in the DSSP calculation
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8
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108
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August 10, 2026
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Terminates abruptly /crashes
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1
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54
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August 10, 2026
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C-rescale barostat and simulated annealing
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4
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80
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August 6, 2026
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Issue generating PFBS anion parameters with LigParGen
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2
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101
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August 5, 2026
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Z‑dimension of the box decreases
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3
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70
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August 5, 2026
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HEAVY_H masses in the CHARMM36m GROMACS force field
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9
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148
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August 5, 2026
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Constructing core shell nanoparticle
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0
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34
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August 4, 2026
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Extend option in gmx convert-tpr
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12
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6108
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August 3, 2026
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