| .. | | 03-May-2022 | - |
| freeenergy/ | H | 03-May-2022 | - | 5,373 | 4,992 |
| 1quantum.ndx | H A D | 05-Nov-2021 | 236 | 9 | 8 |
| 2quantum.ndx | H A D | 05-Nov-2021 | 251 | 9 | 8 |
| 4water.gro | H A D | 05-Nov-2021 | 601 | 16 | 15 |
| 4water.top | H A D | 05-Nov-2021 | 1.4 KiB | 49 | 39 |
| OctaneSandwich.gro | H A D | 05-Nov-2021 | 931.4 KiB | 13,825 | 13,824 |
| OctaneSandwich.ndx | H A D | 05-Nov-2021 | 136.1 KiB | 1,745 | 1,744 |
| OctaneSandwich.top | H A D | 05-Nov-2021 | 16.5 KiB | 573 | 558 |
| ala.gro | H A D | 05-Nov-2021 | 1.6 KiB | 27 | 26 |
| ala.ndx | H A D | 05-Nov-2021 | 756 | 25 | 24 |
| ala.top | H A D | 05-Nov-2021 | 7.5 KiB | 257 | 242 |
| alanine_vsite.itp | H A D | 05-Nov-2021 | 8 KiB | 259 | 246 |
| alanine_vsite_solvated.gro | H A D | 05-Nov-2021 | 62.3 KiB | 927 | 926 |
| alanine_vsite_solvated.ndx | H A D | 05-Nov-2021 | 4.6 KiB | 64 | 63 |
| alanine_vsite_solvated.top | H A D | 05-Nov-2021 | 592 | 29 | 21 |
| alanine_vsite_vacuo.gro | H A D | 05-Nov-2021 | 2.1 KiB | 33 | 32 |
| alanine_vsite_vacuo.ndx | H A D | 05-Nov-2021 | 157 | 4 | 3 |
| alanine_vsite_vacuo.top | H A D | 05-Nov-2021 | 265 | 15 | 10 |
| allquantum.ndx | H A D | 05-Nov-2021 | 281 | 9 | 8 |
| angles1.gro | H A D | 05-Nov-2021 | 343 | 8 | 7 |
| angles1.ndx | H A D | 05-Nov-2021 | 31 | 3 | 2 |
| angles1.top | H A D | 05-Nov-2021 | 1.9 KiB | 73 | 63 |
| argon12.gro | H A D | 05-Nov-2021 | 893 | 16 | 15 |
| argon12.ndx | H A D | 05-Nov-2021 | 109 | 5 | 4 |
| argon12.top | H A D | 05-Nov-2021 | 710 | 32 | 24 |
| argon5832.gro | H A D | 05-Nov-2021 | 393 KiB | 5,836 | 5,835 |
| argon5832.ndx | H A D | 05-Nov-2021 | 86.6 KiB | 1,171 | 1,170 |
| argon5832.top | H A D | 05-Nov-2021 | 708 | 32 | 24 |
| butane1.gro | H A D | 05-Nov-2021 | 231 | 8 | 7 |
| butane1.ndx | H A D | 05-Nov-2021 | 31 | 3 | 2 |
| butane_a0.xvg | H A D | 05-Nov-2021 | 11.3 KiB | 187 | 186 |
| butane_b0.xvg | H A D | 05-Nov-2021 | 18.7 KiB | 307 | 306 |
| butane_d0.xvg | H A D | 05-Nov-2021 | 22.6 KiB | 367 | 366 |
| dipoles.gro | H A D | 05-Nov-2021 | 329 | 8 | 7 |
| dipoles.ndx | H A D | 05-Nov-2021 | 31 | 3 | 2 |
| dipoles.top | H A D | 05-Nov-2021 | 514 | 29 | 21 |
| glycine_no_constraints_vacuo.gro | H A D | 05-Nov-2021 | 495 | 14 | 13 |
| glycine_no_constraints_vacuo.ndx | H A D | 05-Nov-2021 | 61 | 3 | 2 |
| glycine_no_constraints_vacuo.top | H A D | 05-Nov-2021 | 186 | 13 | 9 |
| glycine_vacuo.gro | H A D | 05-Nov-2021 | 495 | 14 | 13 |
| glycine_vacuo.itp | H A D | 05-Nov-2021 | 2.7 KiB | 88 | 81 |
| glycine_vacuo.ndx | H A D | 05-Nov-2021 | 102 | 5 | 4 |
| glycine_vacuo.top | H A D | 05-Nov-2021 | 186 | 13 | 9 |
| lysozyme.pdb | H A D | 05-Nov-2021 | 12.2 KiB | | |
| lysozyme.top | H A D | 05-Nov-2021 | 43.4 KiB | 1,466 | 1,456 |
| mindist.ndx | H A D | 05-Nov-2021 | 87 | 13 | 12 |
| mindist_coords.gro | H A D | 05-Nov-2021 | 185 | 6 | 6 |
| nonanol_vacuo.gro | H A D | 05-Nov-2021 | 2.6 KiB | 40 | 39 |
| nonanol_vacuo.ndx | H A D | 05-Nov-2021 | 194 | 6 | 4 |
| nonanol_vacuo.top | H A D | 05-Nov-2021 | 15.2 KiB | 310 | 297 |
| one-tip5p.g96 | H A D | 05-Nov-2021 | 435 | 14 | 13 |
| one-tip5p.ndx | H A D | 05-Nov-2021 | 36 | 3 | 2 |
| one-tip5p.top | H A D | 05-Nov-2021 | 1.9 KiB | 57 | 46 |
| orires_1lvz.gro | H A D | 05-Nov-2021 | 14.8 KiB | 219 | 218 |
| orires_1lvz.ndx | H A D | 05-Nov-2021 | 1.4 KiB | 24 | 23 |
| orires_1lvz.top | H A D | 05-Nov-2021 | 55.2 KiB | 1,821 | 1,805 |
| scaled-water.g96 | H A D | 05-Nov-2021 | 513 | 15 | 14 |
| scaled-water.ndx | H A D | 05-Nov-2021 | 119 | 7 | 6 |
| scaled-water.top | H A D | 05-Nov-2021 | 1 KiB | 35 | 27 |
| spc-and-methanol.gro | H A D | 05-Nov-2021 | 489 | 10 | 9 |
| spc-and-methanol.ndx | H A D | 05-Nov-2021 | 91 | 7 | 6 |
| spc-and-methanol.top | H A D | 05-Nov-2021 | 1.8 KiB | 68 | 51 |
| spc-dimer.g96 | H A D | 05-Nov-2021 | 512 | 15 | 14 |
| spc-dimer.ndx | H A D | 05-Nov-2021 | 41 | 3 | 2 |
| spc-dimer.top | H A D | 05-Nov-2021 | 160 | 14 | 10 |
| spc2-traj.g96 | H A D | 05-Nov-2021 | 1.4 KiB | 48 | 47 |
| spc2-traj.gro | H A D | 05-Nov-2021 | 941 | 19 | 17 |
| spc2-traj.pdb | H A D | 05-Nov-2021 | 1.3 KiB | | |
| spc2.gro | H A D | 05-Nov-2021 | 449 | 10 | 8 |
| spc2.ndx | H A D | 05-Nov-2021 | 117 | 7 | 6 |
| spc2.top | H A D | 05-Nov-2021 | 782 | 31 | 24 |
| spc216.gro | H A D | 05-Nov-2021 | 43.7 KiB | 652 | 651 |
| spc216.ndx | H A D | 05-Nov-2021 | 3.2 KiB | 46 | 45 |
| spc216.top | H A D | 05-Nov-2021 | 177 | 13 | 9 |
| spc216_with_methane.gro | H A D | 05-Nov-2021 | 44.1 KiB | 657 | 656 |
| spc216_with_methane.top | H A D | 05-Nov-2021 | 933 | 34 | 26 |
| spc2_and_vacuum.gro | H A D | 05-Nov-2021 | 355 | 10 | 9 |
| spc5.ndx | H A D | 05-Nov-2021 | 47 | 4 | 2 |
| spc5.pdb | H A D | 05-Nov-2021 | 35.2 KiB | | |
| spc5.top | H A D | 05-Nov-2021 | 105 | 10 | 6 |
| spc5_3.ndx | H A D | 05-Nov-2021 | 30 | 4 | 2 |
| spc_and_methane.gro | H A D | 05-Nov-2021 | 604 | 11 | 11 |
| spc_and_methane.ndx | H A D | 05-Nov-2021 | 107 | 7 | 6 |
| spc_and_methane.top | H A D | 05-Nov-2021 | 933 | 34 | 26 |
| sw-dimer.g96 | H A D | 05-Nov-2021 | 786 | 19 | 18 |
| sw-dimer.ndx | H A D | 05-Nov-2021 | 61 | 3 | 2 |
| sw-dimer.top | H A D | 05-Nov-2021 | 3.8 KiB | 157 | 138 |
| tip3p5.gro | H A D | 05-Nov-2021 | 1.1 KiB | 19 | 18 |
| tip3p5.ndx | H A D | 05-Nov-2021 | 87 | 3 | 2 |
| tip3p5.top | H A D | 05-Nov-2021 | 174 | 12 | 9 |
| villin.g96 | H A D | 05-Nov-2021 | 17.6 KiB | 265 | 264 |
| villin.ndx | H A D | 05-Nov-2021 | 1.3 KiB | 20 | 19 |
| villin.top | H A D | 05-Nov-2021 | 73.5 KiB | 2,453 | 2,437 |