Ecosyste.ms: Packages
An open API service providing package, version and dependency metadata of many open source software ecosystems and registries.
pypi.org "molssi-seamm" keyword
control-parameters-step 2023.11.15
A SEAMM plug-in for defining command-line parameters for a flowchart.15 versions - Latest release: 6 months ago - 1 dependent repositories - 155 downloads last month - 0 stars on GitHub - 1 maintainer
read-structure-step 2023.11.16
A SEAMM plug-in to read common formats in computational chemistry29 versions - Latest release: 6 months ago - 1 dependent repositories - 412 downloads last month - 0 stars on GitHub - 1 maintainer
seamm-util 2024.4.30
seamm_util36 versions - Latest release: 17 days ago - 24 dependent packages - 15 dependent repositories - 987 downloads last month - 1 stars on GitHub - 1 maintainer
Top 8.7% on pypi.org
83 versions - Latest release: 14 days ago - 26 dependent packages - 24 dependent repositories - 1.37 thousand downloads last month - 11 stars on GitHub - 1 maintainer
seamm 2024.5.3
The core of the SEAMM environment and graphical interface.83 versions - Latest release: 14 days ago - 26 dependent packages - 24 dependent repositories - 1.37 thousand downloads last month - 11 stars on GitHub - 1 maintainer
molsystem 2024.5.8
molsystem56 versions - Latest release: 9 days ago - 7 dependent packages - 2 dependent repositories - 1.07 thousand downloads last month - 3 stars on GitHub - 2 maintainers
custom-step 2023.12.12
A SEAMM plug-in for custom Python scripts in a flowchart.12 versions - Latest release: 5 months ago - 1 dependent repositories - 201 downloads last month - 0 stars on GitHub - 1 maintainer
table-step 2023.11.10
A SEAMM plug-in for data tables in a flowchart.15 versions - Latest release: 6 months ago - 1 dependent repositories - 192 downloads last month - 0 stars on GitHub - 1 maintainer
supercell-step 2023.11.5
A SEAMM plug-in for building supercells of periodic systems.7 versions - Latest release: 6 months ago - 1 dependent repositories - 110 downloads last month - 0 stars on GitHub - 1 maintainer
set-cell-step 2021.10.14
A SEAMM plug-in for setting the periodic (unit) cell.4 versions - Latest release: over 2 years ago - 1 dependent repositories - 33 downloads last month - 0 stars on GitHub - 1 maintainer
psi4-step 2024.3.17
A SEAMM plug-in to setup, run and analyze quantum chemistry calculations using Psi428 versions - Latest release: 2 months ago - 1 dependent repositories - 164 downloads last month - 3 stars on GitHub - 1 maintainer
loop-step 2023.11.9
A SEAMM plug-in which provides loops in flowcharts.23 versions - Latest release: 6 months ago - 1 dependent repositories - 315 downloads last month - 1 stars on GitHub - 1 maintainer
lammps-step 2024.3.22
A SEAMM plug-in for LAMMPS, a forcefield-based molecular dynamics code.48 versions - Latest release: about 2 months ago - 1 dependent repositories - 317 downloads last month - 2 stars on GitHub - 1 maintainer
from-smiles-step 2023.11.10
A SEAMM plug-in for creating structures from a SMILES string.24 versions - Latest release: 6 months ago - 2 dependent repositories - 268 downloads last month - 0 stars on GitHub - 1 maintainer
crystal-builder-step 2022.7.31
A SEAMM plug-in for creating crystals from prototypes, including Strukturbericht designations.6 versions - Latest release: almost 2 years ago - 1 dependent repositories - 117 downloads last month - 0 stars on GitHub - 1 maintainer
seamm-cookiecutter 2022.10.20
Cookiecutter for SEAMM plug-ins, substeps and forcefields6 versions - Latest release: over 1 year ago - 1 dependent repositories - 47 downloads last month - 1 stars on GitHub - 1 maintainer
dftbplus-step 2024.4.24
A SEAMM plug-in for DFTB+, a fast quantum mechanical simulation code.34 versions - Latest release: 23 days ago - 1 dependent repositories - 368 downloads last month - 1 stars on GitHub - 1 maintainer
Related Keywords
computational-chemistry
16
computational-materials-science
16
molssi
16
SEAMM
14
plug-in
12
flowchart
12
atomistic
5
unitcell
2
crystal
2
DFT
2
prototype
1
Strukturbericht
1
molecule
1
SMILES
1
lammps
1
MD
1
molecular dynamics
1
OpenKIM
1
EAM
1
cookiecutter
1
template
1
package
1
MolSSI
1
quantum
1
simulation
1
DFTB+
1
DFTBplus
1
tight-binding
1
dftb
1
dftbplus
1
Open Babel
1
molecules
1
files
1
seamm_util
1
seamm
1
molsystem
1
custom
1
python
1
table
1
data
1
csv
1
supercell
1
periodic
1
Psi4
1
quantum chemistry
1
CCSD
1
psi4
1
control
1
loops
1
forcefield
1