Name | Version | Summary | date |
psi4-step |
2024.3.17 |
A SEAMM plug-in to setup, run and analyze quantum chemistry calculations using Psi4 |
2024-03-17 21:24:23 |
seamm-installer |
2024.3.17 |
The installer/updater for SEAMM (Simulation Environment for Atomistic and Molecular Simulations). |
2024-03-17 19:09:45 |
mopac-step |
2024.3.17 |
A SEAMM plug-in to setup, run and analyze semiempirical calculations with MOPAC |
2024-03-17 10:06:49 |
Gh0stSimpleDiagramTool |
0.0.4 |
A simple diagram drawing tool |
2024-03-14 17:35:22 |
gh0st-SimpleDiagramTool |
0.0.1 |
A simple diagram drawing tool |
2024-03-14 06:27:41 |
fhi-aims-step |
2024.1.19 |
A SEAMM plug-in for FHI-aims |
2024-01-19 20:35:52 |
gaussian-step |
2024.1.19 |
A SEAMM plugin for A SEAMM plug-in for Gaussian |
2024-01-19 18:18:28 |
dftbplus-step |
2024.1.18 |
A SEAMM plug-in for DFTB+, a fast quantum mechanical simulation code. |
2024-01-19 00:20:38 |
forcefield-step |
2024.1.10 |
A SEAMM plug-in for setting up a forcefield or EAM potentials for subsequent simulations. |
2024-01-10 16:16:11 |
schemdraw |
0.18 |
Electrical circuit schematic drawing |
2023-12-29 19:10:44 |
custom-step |
2023.12.12 |
A SEAMM plug-in for custom Python scripts in a flowchart. |
2023-12-12 20:17:12 |
py2flowchart |
0.0.3 |
Generates flowchart from Python functions. |
2023-12-09 03:21:44 |
read-structure-step |
2023.11.16 |
A SEAMM plug-in to read common formats in computational chemistry |
2023-11-16 19:46:01 |
quickmin-step |
2023.11.15 |
A SEAMM plug-in for simple, quick minimization |
2023-11-15 15:36:26 |
table-step |
2023.11.10 |
A SEAMM plug-in for data tables in a flowchart. |
2023-11-10 11:20:58 |
from-smiles-step |
2023.11.10 |
A SEAMM plug-in for creating structures from a SMILES string. |
2023-11-10 11:15:07 |
supercell-step |
2023.11.5 |
A SEAMM plug-in for building supercells of periodic systems. |
2023-11-05 22:13:33 |
loop-step |
2023.10.30 |
A SEAMM plug-in which provides loops in flowcharts. |
2023-10-30 15:39:12 |
control-parameters-step |
2023.10.21 |
A SEAMM plug-in for defining command-line parameters for a flowchart. |
2023-10-21 16:52:34 |
diffusivity-step |
2023.9.4 |
A SEAMM plug-in for Diffusivity |
2023-09-04 17:45:26 |