File tree Expand file tree Collapse file tree 1 file changed +4
-4
lines changed
Expand file tree Collapse file tree 1 file changed +4
-4
lines changed Original file line number Diff line number Diff line change @@ -51,7 +51,7 @@ Computational chemistry software dependencies
5151At the backend, MISPR uses:
5252
5353.. list-table ::
54- :widths: 20 15 50 15
54+ :widths: 20 25 40 15
5555 :header-rows: 1
5656
5757 * - Software
@@ -62,9 +62,9 @@ At the backend, MISPR uses:
6262 - Commercial
6363 - Perform DFT calculations
6464 - License required
65- * - `AmberTools <https://ambermd.org/AmberTools.php >`_
65+ * - `AmberTools24 <https://ambermd.org/AmberTools.php >`_
6666 - Open Source
67- - Generate GAFF parameter
67+ - Generate GAFF parameters
6868 - Direct download
6969 * - `LAMMPS <https://www.lammps.org >`_
7070 - Open Source
@@ -76,7 +76,7 @@ At the backend, MISPR uses:
7676 - Follow `user guide <https://m3g.github.io/packmol/userguide.shtml >`_
7777 * - `Schrödinger <https://www.schrodinger.com/ >`_
7878 - Commercial (Academic license available)
79- - Generate OPLS2005 parameter (Optional)
79+ - Generate OPLS2005 parameters (Optional)
8080 - License required
8181
8282Ensure that you have access to the executables of these software
You can’t perform that action at this time.
0 commit comments