RaphaelRobidas's Stars
openai/whisper
Robust Speech Recognition via Large-Scale Weak Supervision
Delgan/loguru
Python logging made (stupidly) simple
rqlite/rqlite
The lightweight, user-friendly, distributed relational database built on SQLite.
overleaf/overleaf
A web-based collaborative LaTeX editor
GetPublii/Publii
The most intuitive Static Site CMS designed for SEO-optimized and privacy-focused websites.
mbrlabs/Lorien
Infinite canvas drawing/whiteboarding app for Windows, Linux and macOS. Made with Godot.
google-deepmind/dm-haiku
JAX-based neural network library
google-deepmind/materials_discovery
thomas0809/MolScribe
Robust Molecular Structure Recognition with Image-to-Graph Generation
Cyclenerd/google-cloud-pricing-cost-calculator
💸 Calculate estimated monthly costs of Google Cloud Platform products and resources via YAML files and CLI program (Linux, macOS, Windows)
CambridgeMolecularEngineering/chemdataextractor2
ChemDataExtractor Version 2.0
pyscf/gpu4pyscf
A plugin to use Nvidia GPU in PySCF package
abinit/abipy
Open-source library for analyzing the results produced by ABINIT
jensengroup/molcalc
MolCalc is a web interface that allows anyone to build molecules and calculate molecular properties online
RMeli/spyrmsd
📐 Symmetry-corrected RMSD in Python
grimme-lab/dxtb
Efficient And Fully Differentiable Extended Tight-Binding
zorkzou/Molden2AIM
Molden2AIM is a utility program which can be used to create AIM-WFN, AIM-WFX, and NBO-47 files from a Molden file.
BobHanson/Jmol-SwingJS
SwingJS-compatible Jmol/JSmol for Java and JavaScript molecular visualization and analysis
dylanwal/chemistry_drawer
Draw molecules with plotly!
robashaw/basisopt
Basis set optimization library for quantum chemistry
shin1koda/dmf
A Python implementation of the direct MaxFlux method for transition state search
aaren/pharminv
Python interface to harminv
2AUK/pyRISM
Implementation of the Reference Interaction-Site Model (RISM) equation
grimme-lab/DRACO
Dynamic Radii Adjustment for COntinuum Solvation
pnnl/nmrfit
Quantitative NMR analysis through least-squares fit of spectroscopy data
smeerten/jellyfish
J-coupling simulation software.
Digichem-Project/digichem-core
Core library for Digichem
fewillemann/GFN1-xTB
Semi-empirical DFT model including dispersive energy of organic molecules.
mazarguil/graphkey-rust
An implementation of the Traces algorithm in Rust to enable fast graph isomorphish check and the Hash trait on Graph objects
zarkoivkovicc/GFN1-xTB.jl
Julia code for TCCM Computational Chemistry remote project 2023