pypi.org "Chemistry" keyword
opem 1.4 💰
Open Source PEM Cell Simulation Tool14 versions - Latest release: over 2 years ago - 1 dependent package - 1 dependent repositories - 136 downloads last month - 234 stars on GitHub - 1 maintainer
gopem 0.8 💰
GOPEM is a graphical user interface of OPEM4 versions - Latest release: over 2 years ago - 1 dependent repositories - 22 downloads last month - 39 stars on GitHub - 1 maintainer
pylimer-tools 0.4.1 💰
A toolkit for handling bead-spring polymers and LAMMPS output in Python37 versions - Latest release: 4 days ago - 1 dependent repositories - 519 downloads last month - 15 stars on GitHub - 1 maintainer
bayesianflow-for-chem 3.0.4
Bayesian flow network framework for Chemistry41 versions - Latest release: 4 days ago - 426 downloads last month - 31 stars on GitHub - 1 maintainer
trident-chemwidgets 0.2.1
Jupyter widgets for working with chemical datasets3 versions - Latest release: over 4 years ago - 1 dependent repositories - 71 downloads last month - 33 stars on GitHub - 1 maintainer
turboparse 0.1.2
Parse turbomole outputs and output json or yaml file3 versions - Latest release: over 4 years ago - 1 dependent repositories - 75 downloads last month - 0 stars on gitlab.com - 1 maintainer
tmqmrdfdata 1.0.2
An rdflib-based interface for tmQM-RDF3 versions - Latest release: 5 months ago - 20 downloads last month - 0 stars on GitHub - 1 maintainer
emergex 1.0.0
A package to describe and optimize for emergent behavior using chemical reaction networks (CRNs)....2 versions - Latest release: 7 months ago - 12 downloads last month - 2 stars on GitHub - 1 maintainer
chembfn-webui 2.2.1
WebUI for ChemBFN31 versions - Latest release: 9 months ago - 212 downloads last month - 1 stars on GitHub - 1 maintainer
neurapython 2.1.3
NeuraPython is a unified framework combining AI, Machine Learning, Data Science, Web Development,...19 versions - Latest release: 11 months ago - 121 downloads last month - 1 maintainer
ipyspeck 0.8.4
Speck Jupyter Widget14 versions - Latest release: about 1 month ago - 3 dependent packages - 3 dependent repositories - 2.24 thousand downloads last month - 6 stars on GitHub - 1 maintainer
thermopred 1.0.0
A python package to predict some thermochemical properties.1 version - Latest release: about 1 year ago - 22 downloads last month - 2 stars on GitHub - 1 maintainer
popcornn 0.1.0
Path Optimization with a Continuous Representation Neural Network (popcornn) optimizes molecular ...2 versions - Latest release: about 1 year ago - 4 downloads last month - 23 stars on GitHub - 1 maintainer
gaml 1.2
Genetic Algorithm Machine Learning3 versions - Latest release: over 5 years ago - 1 dependent repositories - 11 downloads last month - 16 stars on GitHub - 1 maintainer
phcal 0.1.0
pH calculation based on MBE, CBE and PBE2 versions - Latest release: almost 2 years ago - 13 downloads last month - 1 stars on GitHub - 1 maintainer
project-ppchem-tools-kit 1.1.0
Basic Chemistry Toolkit6 versions - Latest release: over 2 years ago - 54 downloads last month - 1 maintainer
fgfinder 1.0.1
A package to identify functional groups in molecules.2 versions - Latest release: over 2 years ago - 20 downloads last month - 4 stars on GitHub - 1 maintainer
periodic-table-cli 2.1.3
An interactive Periodic Table of Elements app for the console!13 versions - Latest release: about 1 year ago - 241 downloads last month - 51 stars on GitHub - 1 maintainer
molbokeh 1.0.1
Simple package to display molecules images in bokeh interactive charts.2 versions - Latest release: over 2 years ago - 101 downloads last month - 13 stars on GitHub - 1 maintainer
spectrafp 1.2.5
A package to perform fingerprints from spectroscopy datas.10 versions - Latest release: over 1 year ago - 1 dependent repositories - 91 downloads last month - 8 stars on GitHub - 1 maintainer
gauext 0.2.2
Generic Gaussian External Interface6 versions - Latest release: over 4 years ago - 1 dependent repositories - 19 downloads last month - 1 maintainer
chemyst 2.3.0
Useful functions to work with basic chemistry and stochiemetry9 versions - Latest release: over 5 years ago - 1 dependent repositories - 46 downloads last month - 7 stars on GitHub - 1 maintainer
scripyt-mwfn 1.0.1
A package for Cheminformatics.2 versions - Latest release: almost 6 years ago - 1 dependent repositories - 18 downloads last month - 2 stars on GitHub - 1 maintainer
ultimatechemcalc 3.0
A collection of chemistry-related conversion calculators.12 versions - Latest release: over 5 years ago - 1 dependent repositories - 63 downloads last month - 0 stars on GitHub - 1 maintainer
odachi 1.0.1
Advanced deep learning-based organic retrosynthesis engine10 versions - Latest release: over 6 years ago - 1 dependent repositories - 39 downloads last month - 3 stars on GitHub - 1 maintainer
quantumworld 1.0b0
Basic library for the QuantumWorldX course1 version - Latest release: over 9 years ago - 1 dependent repositories - 11 downloads last month - 1 maintainer
mixsol 1.0.1
Planning tool for combinatorial solution mixing. Reach target solutions from mixes of starting so...9 versions - Latest release: over 1 year ago - 1 dependent repositories - 1.09 thousand downloads last month - 3 stars on GitHub - 1 maintainer
pyadaqsar 1.1.1
A cheminformatics package to perform Applicability Domain of molecular fingerprints based in simi...6 versions - Latest release: almost 3 years ago - 1 dependent repositories - 105 downloads last month - 28 stars on GitHub - 1 maintainer
mol2chemfigpy3 1.6.0
python3 version of mol2chemfig18 versions - Latest release: 10 months ago - 1 dependent repositories - 501 downloads last month - 35 stars on GitHub - 1 maintainer
knopy 0.0
A scientific calculation library for Python1 version - Latest release: over 6 years ago - 1 dependent repositories - 9 downloads last month - 1 stars on GitHub - 1 maintainer
scicalc 0
A scientific calculation library for Python1 version - Latest release: over 6 years ago - 1 dependent repositories - 7 downloads last month - 1 stars on GitHub - 1 maintainer
qcl 0.0.3
Quantum Chemistry Laboratory3 versions - Latest release: over 11 years ago - 2 dependent repositories - 11 downloads last month - 20 stars on GitHub - 1 maintainer
chemica 1.1.0
A simple library that takes chemistry to the next level.2 versions - Latest release: over 5 years ago - 98 downloads last month - 14 stars on GitHub - 1 maintainer
moldes 0.0.4
MolDes python package4 versions - Latest release: over 2 years ago - 17 downloads last month - 1 maintainer
Top 9.9% on pypi.org
33 versions - Latest release: about 4 years ago - 2 dependent repositories - 2.53 thousand downloads last month - 63 stars on GitHub - 1 maintainer
chemlib 2.2.4
An easy-to-use library that quickly performs chemistry calculations.33 versions - Latest release: about 4 years ago - 2 dependent repositories - 2.53 thousand downloads last month - 63 stars on GitHub - 1 maintainer
quantumworldx 0.18.44
Basic library for the QuantumWorld edX course66 versions - Latest release: about 9 years ago - 1 dependent repositories - 151 downloads last month - 1 maintainer
Related Keywords
chemistry
11
Cheminformatics
6
cheminformatics
5
python
5
QSAR
4
qsar
4
Quantum
4
Math
3
Physics
3
Simulation
3
Science
3
qspr
3
machine-learning
3
QSPR
3
python3
2
Calculation
2
Data Science
2
AI
2
Deep Learning
2
simulation
2
Fingerprint
2
Spectroscopy
2
physics-simulation
2
physics
2
opem
2
OPEM
2
PEM
2
FC
2
CELL
2
Fuel-Cell
2
electrochemistry
2
fuel-cell
2
Visualization
2
IPython
2
molecule-visualization
2
Widgets
2
molecule
2
Jupyter
2
CLM
2
ChemBFN
2
molecular-design-tool
2
molecular-design
1
molecular-modeling
1
transformer
1
Periodic Table
1
Periodic Table of Elements
1
periodic
1
periodic-table-cli
1
elements
1
atoms
1
atomic
1
cli
1
console
1
terminal
1
shell
1
unicode
1
ascii-art
1
Mixing
1
pypi-package
1
CNN
1
Tools kit
1
Graph maker
1
Linear regression
1
Molecular structure
1
Molecular mass
1
Uncertainty propagation
1
standard deviation
1
tkinter interface
1
LaTeX
1
SMILES
1
Mole
1
Stoichiometry
1
Conversion
1
Chemical
1
Equation
1
Multiwfn
1
quantum-chemistry
1
qtaim
1
bayesian-flow-networks
1
generative-model
1
Molarity
1
Planning
1
Solution
1
RDF
1
Transition metal complexes
1
pH
1
MBE
1
CBE
1
PBE
1
Analytical Chemistry
1
analytical-chemistry
1
cbe
1
chemoinformatics
1
pbe
1
Transition State
1
Reaction path
1
Minimum Energy Path
1
Geodesic
1
JupyterLab
1
Molecule
1