proxy.golang.org "materials-science" keyword
View the packages on the proxy.golang.org package registry that are tagged with the "materials-science" keyword.
Top 5.6% on proxy.golang.org
25 versions - Latest release: 2 months ago - 152 stars on GitHub
github.com/lab-cosmo/chemiscope v0.8.6
An interactive structure/property explorer for materials and molecules25 versions - Latest release: 2 months ago - 152 stars on GitHub
Top 5.6% on proxy.golang.org
27 versions - Latest release: about 2 years ago - 37 stars on GitHub
github.com/sparks-baird/xtal2png v0.9.6
Encode/decode a crystal structure to/from a grayscale PNG image for direct use with image-based m...27 versions - Latest release: about 2 years ago - 37 stars on GitHub
Top 5.6% on proxy.golang.org
4 versions - Latest release: about 6 years ago - 7 stars on GitHub
github.com/Exabyte-io/esse v2.0.0+incompatible
JSON schemas and examples representing structural data, characteristic properties, modeling workf...4 versions - Latest release: about 6 years ago - 7 stars on GitHub
Top 5.6% on proxy.golang.org
2 versions - Latest release: about 4 years ago - 158 stars on GitHub
github.com/materialsproject/matbench v0.1.1
Matbench: Benchmarks for materials science property prediction2 versions - Latest release: about 4 years ago - 158 stars on GitHub
Top 5.6% on proxy.golang.org
55 versions - Latest release: 8 days ago - 253 stars on GitHub
github.com/janosh/pymatviz v0.17.0
A toolkit for visualizations in materials informatics.55 versions - Latest release: 8 days ago - 253 stars on GitHub
Top 5.6% on proxy.golang.org
65 versions - Latest release: about 2 months ago - 1,655 stars on GitHub
github.com/deepmodeling/deepmd-kit v3.1.0+incompatible
A deep learning package for many-body potential energy representation and molecular dynamics65 versions - Latest release: about 2 months ago - 1,655 stars on GitHub
Top 6.0% on proxy.golang.org
4 versions - Latest release: 7 days ago - 1,435 stars on GitHub
github.com/microsoft/mattergen v1.0.3
Official implementation of MatterGen -- a generative model for inorganic materials design across ...4 versions - Latest release: 7 days ago - 1,435 stars on GitHub
Top 5.6% on proxy.golang.org
22 versions - Latest release: over 1 year ago - 231 stars on GitHub
github.com/materialsproject/atomate2 v0.1.14
atomate2 is a library of computational materials science workflows22 versions - Latest release: over 1 year ago - 231 stars on GitHub
Top 5.6% on proxy.golang.org
7 versions - Latest release: almost 5 years ago - 18 stars on GitHub
github.com/tilde-lab/tilde v0.9.6
Materials informatics framework for ab initio data repositories7 versions - Latest release: almost 5 years ago - 18 stars on GitHub
Top 9.6% on proxy.golang.org
30 versions - Latest release: about 1 month ago - 166 stars on GitHub
github.com/pycroscopy/atomai v0.8.1
Deep and Machine Learning for Microscopy30 versions - Latest release: about 1 month ago - 166 stars on GitHub
Top 5.6% on proxy.golang.org
35 versions - Latest release: over 6 years ago - 529 stars on GitHub
github.com/materialsvirtuallab/megnet v2019.4.8+incompatible
Graph Networks as a Universal Machine Learning Framework for Molecules and Crystals35 versions - Latest release: over 6 years ago - 529 stars on GitHub
Top 5.6% on proxy.golang.org
7 versions - Latest release: about 7 years ago - 94 stars on GitHub
github.com/suncat-center/catkit v0.5.2
General purpose tools for high-throughput catalysis7 versions - Latest release: about 7 years ago - 94 stars on GitHub
Top 5.6% on proxy.golang.org
7 versions - Latest release: about 7 years ago - 94 stars on GitHub
github.com/SUNCAT-Center/CatKit v0.5.2
General purpose tools for high-throughput catalysis7 versions - Latest release: about 7 years ago - 94 stars on GitHub
Top 5.6% on proxy.golang.org
9 versions - Latest release: about 1 year ago - 428 stars on GitHub
github.com/singroup/dscribe v2.1.1+incompatible
DScribe is a python package for creating machine learning descriptors for atomistic systems.9 versions - Latest release: about 1 year ago - 428 stars on GitHub
Top 5.6% on proxy.golang.org
9 versions - Latest release: about 1 year ago - 428 stars on GitHub
github.com/SINGROUP/dscribe v2.1.1+incompatible
DScribe is a python package for creating machine learning descriptors for atomistic systems.9 versions - Latest release: about 1 year ago - 428 stars on GitHub
Top 5.6% on proxy.golang.org
1 version - Latest release: over 4 years ago - 261 stars on GitHub
github.com/lukasturcani/stk v2020.12.26+incompatible
A Python library which allows construction and manipulation of complex molecules, as well as auto...1 version - Latest release: over 4 years ago - 261 stars on GitHub
Top 5.6% on proxy.golang.org
15 versions - Latest release: 4 months ago - 413 stars on GitHub
github.com/materialsvirtuallab/maml v2025.4.1+incompatible
Python for Materials Machine Learning, Materials Descriptors, Machine Learning Force Fields, Deep...15 versions - Latest release: 4 months ago - 413 stars on GitHub
Related Keywords
machine-learning
9
materials-informatics
6
python
5
deep-learning
4
computational-chemistry
4
materials-design
3
materials
3
descriptors
2
atomistic-systems
2
combinatorics
2
chemical-reaction-networks
2
chemical-kinetics
2
chemical-engineering
2
catalyst
2
catalysis-informatics
2
pytorch
2
tensorflow
2
vasp
2
chemistry
2
crystallography
2
spectroscopy
1
ab-initio
1
crystal-structure
1
quantum-espresso
1
materials-discovery
1
deep-kernel-learning
1
machine-learning-force-field
1
electron-microscopy
1
ensemble-learning
1
fully-convolutional-networks
1
google-colaboratory
1
imaging
1
jupyter-notebook
1
microscopy
1
multivariate-analysis
1
reactions
1
scanning-probe-microscopy
1
semantic-segmentation
1
variational-autoencoders
1
graph-networks
1
keras
1
molecular-structures
1
molecular-modeling
1
molecular-evolution
1
materials-screening
1
materials-discoveries
1
computational-science
1
cheminformatics
1
high-throughput
1
plots
1
plotly
1
matplotlib
1
data-visualization
1
physics
1
machine-learning-algorithms
1
data-science
1
condensed-matter
1
benchmark
1
simulation-modeling
1
materials-genome
1
digital-transformation
1
density-functional-theory
1
image-processing
1
web
1
visualization
1
molecule
1
hacktoberfest
1
dft
1
automation
1
generative-ai
1
rocm
1
potential-energy
1
paddle
1
nodejs
1
molecular-dynamics
1
lammps
1
jax
1
ipi
1
deepmd
1
cuda
1
cpp
1
c
1
ase
1
uncertainty-calibration
1
uncertainty
1