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Forcefield parameters addition for LiTFSI in opls-aa
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3
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20
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April 11, 2026
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Different conformers generated for the same amide molecule when different SMILES are provided
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0
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16
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April 5, 2026
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Exceeded iteration error while running with coarse grained force field
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2
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37
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March 30, 2026
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Field PCFF not found
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7
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953
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March 30, 2026
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Incorporating Fluorene (C13H10) into EMC with OPLS-AA/2024 – Missing Typing Rules
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1
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39
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March 29, 2026
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Bottlebrush type polymer
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3
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65
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February 17, 2026
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Martini FF, polymer, Segmentation fault (core dumped)
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0
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28
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February 9, 2026
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Error while running EMC setup.esh script
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0
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45
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January 28, 2026
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How to define user force fields with EMC
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8
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167
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January 28, 2026
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About boundary conditions
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2
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61
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January 21, 2026
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Atom typing error when building a styrene dimer using a user-defined force field
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7
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156
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January 17, 2026
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OPLS‑AA (2024) missing parameters for MAH‑g‑PE
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6
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77
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January 16, 2026
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Adding missing parameters for polymers with OPLS-AA using quantum mechanical (QM) calculations
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6
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148
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January 6, 2026
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Using CVFF forcefield with Enhanced Monte Carlo
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3
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80
|
January 3, 2026
|
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How to construct a coarse-grain polymer model using EMC?
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2
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115
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January 2, 2026
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Missing OPLS-AA parameters for furfural and acetonitrile
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3
|
88
|
December 27, 2025
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Advice on generating dendrimers in EMC and force fields
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1
|
84
|
December 27, 2025
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Issues with OPLS-AA dihedral coefficients in LAMMPS parameter file
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2
|
104
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December 25, 2025
|
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EMC license
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0
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43
|
December 3, 2025
|
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Missing opls-aa parameters
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3
|
176
|
September 20, 2025
|
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How to assign atom types directly without using a .top file
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1
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60
|
September 20, 2025
|
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EMC Release v9.4.4 20250801
|
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8
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171
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August 24, 2025
|
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Missing rules error for simple polymer with OPLS-AA
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5
|
235
|
August 12, 2025
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EMC bug for overriding force field charges in groups with polymerization endpoints
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4
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115
|
August 8, 2025
|
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Using COMPASS forcefield with EMC
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9
|
860
|
July 18, 2025
|
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Trappe force field error?
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2
|
61
|
June 30, 2025
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Building Star Polymers? At Least a Graft Example?
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0
|
45
|
June 28, 2025
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Terminating an imported structure with a one-site group
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0
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37
|
June 27, 2025
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branched polymers
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0
|
51
|
June 20, 2025
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Incorporating custom force field into built crystal structure
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4
|
110
|
June 18, 2025
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