2-day current streak·290-day longest streak
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tools ★ PINNED
Tools and scripts I wrote and regularly use
Jupyter Notebook ★ 76 4y agoExplain → -
PapersBot ★ PINNED
Read journal RSS feeds and tweet selected entries
Python ★ 61 2mo agoExplain → -
citable-data ★ PINNED
Data, in citable form, produced by the Coudert research group
C ★ 45 2mo agoExplain → -
gfortran-for-macOS ★ PINNED
GNU Fortran (and GCC) compilers for macOS
Perl ★ 358 1y agoExplain → -
xmgrace
Grace (xmgrace) plotting tool
C ★ 14 9y agoExplain → -
MOF_papers
Code and data for the @MOF_papers twitter bot
★ 10 2h agoExplain → -
symmol
SYMMOL: a program to find the maximum symmetry group in an atom cluster
Fortran ★ 9 6y agoExplain → -
zeolite_databases
Databases of zeolitic structures
★ 8 1y agoExplain → -
gcc ⑂
No description.
★ 5 4y agoExplain → -
misc
Miscellaneous projects
Jupyter Notebook ★ 3 3y agoExplain → -
binders
This repository contains some Python binders for teaching, by François-Xavier Coudert
Jupyter Notebook ★ 2 7mo agoExplain → -
topology_databases
No description.
Jupyter Notebook ★ 2 8mo agoExplain → -
BET_isotherms_reproducibility
No description.
Jupyter Notebook ★ 2 4y agoExplain → -
gcc-darwin-arm64 ⑂
[August 2020, created] Branches with work in progress on making an Arm64 Darwin port.
★ 2 23d agoExplain → -
citedoi
No description.
TeX ★ 2 11y agoExplain → -
Yggdrasil ⑂
Collection of builder repositories for BinaryBuilder.jl
★ 1 8mo agoExplain → -
zeoplusplus ⑂
Mirror of http://zeoplusplus.org/
C++ ★ 1 2y agoExplain → -
homebrew-chemistry
Homebrew tap for open source chemistry software on macOS
Ruby ★ 1 5y agoExplain → -
jax-feedstock ⑂
A conda-smithy repository for jax.
★ 0 3mo agoExplain → -
pyodide-recipes ⑂
Collections of package recipes for Pyodide
★ 0 4mo agoExplain → -
cuequivariance-torch-feedstock ⑂
A conda-smithy repository for cuequivariance-torch.
★ 0 3mo agoExplain → -
BinaryBuilderBase.jl ⑂
No description.
★ 0 9mo agoExplain → -
numpy-release ⑂
Repository for building numpy release artifacts and making releases to PyPI
★ 0 8mo agoExplain → -
ctng-compiler-activation-feedstock ⑂
A conda-smithy repository for ctng-compiler-activation.
★ 0 9mo agoExplain → -
gfortran_impl_osx-64-feedstock ⑂
A conda-smithy repository for gfortran_impl_osx-64.
★ 0 9mo agoExplain → -
adsorption-file-parser ⑂
A pure python parser to sorption files from various instrumentation manufacturers.
★ 0 1y agoExplain → -
betsi-gui ⑂
BET Surface Identification - a program that fully implements the rouquerol criteria
Python ★ 0 1y agoExplain → -
pyGAPS ⑂
A framework for processing adsorption data and isotherm fitting
★ 0 1y agoExplain → -
pymace-feedstock ⑂
A conda-smithy repository for pymace.
★ 0 10mo agoExplain → -
cuequivariance-jax-feedstock ⑂
A conda-smithy repository for cuequivariance-jax.
★ 0 3mo agoExplain → -
cuequivariance-feedstock ⑂
A conda-smithy repository for cuequivariance.
★ 0 4mo agoExplain → -
lammps ⑂
Public development project of the LAMMPS MD software package
★ 0 1y agoExplain → -
staged-recipes ⑂
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
★ 0 1y agoExplain → -
moxel ⑂
Python package for parallel calculation of energy voxels.
★ 0 1y agoExplain → -
matten ⑂
MatTen: Equivariant Graph Neural Nets for Tensorial Properties of Materials
Jupyter Notebook ★ 0 2y agoExplain → -
RASPA2 ⑂
Classical molecular simulation code
C ★ 0 2y agoExplain → -
Atomes ⑂
Atomes software
C ★ 0 3y agoExplain → -
homebrew-core ⑂
:beers: Core formulae for the Homebrew package manager
Ruby ★ 0 1y agoExplain → -
julia ⑂
The Julia Programming Language
★ 0 10mo agoExplain → -
formula-patches ⑂
🏥 Patches for Homebrew formulae
C ★ 0 4y agoExplain → -
gemmi ⑂
macromolecular crystallography library and utilities
★ 0 6y agoExplain → -
chemfiles ⑂
Library for reading and writing chemistry files
★ 0 5y agoExplain → -
brew ⑂
🍺 The missing package manager for macOS
Ruby ★ 0 1y agoExplain →
No repos match these filters.