PyDigger - unearthing stuff about Python


NameVersionSummarydate
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
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