Alternatives and similar repositories for litdb

Users that are interested in litdb are comparing it to the libraries listed below

• jkitchin / literature-alerts
  ☆12Updated 3 months ago
• fxcoudert / tools
  Tools and scripts I wrote and regularly use
  ☆75Updated 3 years ago
• jkitchin / dft-course
  Course repository for 06-640 - Molecular simulation
  ☆25Updated 13 years ago
• pylada / pylada
  High-Throughput Computational Physics Framework
  ☆13Updated 8 years ago
• bruceravel / XAS-Education
  Educational materials for XAS training courses
  ☆25Updated last year
• atomgptlab / chatgpt_material_explorer
  CME-ChatGPT Material Explorer
  ☆23Updated 7 months ago
• ziatdinovmax / SciLink
  LLM-powered agents for scientific research automation
  ☆44Updated last week
• superstar54 / blase
  Python module for drawing and rendering ASE (Atomic Simulation Environment) atoms and molecules objects using blender.
  ☆13Updated 3 years ago
• usnistgov / MDCS
  ☆39Updated 2 weeks ago
• aspuru-guzik-group / Beyond-Molecular-Structure-ML-for-OPV-Materials-Devices
  ☆14Updated last year
• jkitchin / pycse
  Python computations in science and engineering
  ☆271Updated last week
• CurtisColwell / StrainViz
  Strain Visualization for Inherently Strained Organic Molecules
  ☆24Updated 2 years ago
• aspuru-guzik-group / atlas
  A brain for self-driving laboratories
  ☆46Updated 8 months ago
• usnistgov / pyPRISM
  A framework for conducting polymer reference interaction site model (PRISM) calculations
  ☆45Updated 3 weeks ago
• hasan-sayeed / RAGSkeleton
  RAGSkeleton: A foundational, modular framework for building customizable Retrieval-Augmented Generation (RAG) systems across any domain.
  ☆14Updated 7 months ago
• usnistgov / intermat
  Project to setup and analyze interface calculations using density functional theory.
  ☆23Updated 5 months ago
• jkitchin / s20-06681
  Data science and machine learning in chemical engineering
  ☆25Updated 5 years ago
• radi0sus / orca_ir
  Plots IR spectra from from ORCA output files
  ☆22Updated last year
• aiidateam / aiida-tutorials
  AiiDA tutorials web site
  ☆24Updated 4 months ago
• sparks-baird / auto-paper
  The aim of auto-paper is to give you tips, tricks, and tools to accelerate your publication rate and improve publication quality.
  ☆72Updated 3 years ago
• simongravelle / GOMC-inputs
  Input script for Monte Carlo (GCMC) simulations
  ☆20Updated last year
• gicrisf / tochemfig
  Make Emacs write chemfig code from molfile or SMILES.
  ☆12Updated last year
• jaapkroe / polypy
  polygon (ring network) discovery from XYZ files
  ☆10Updated 9 years ago
• MLMI2-CSSI / foundry
  Simplifying the discovery and usage of machine-learning ready datasets in materials science and chemistry
  ☆85Updated 3 weeks ago
• danieleongari / awesome-design-of-experiments
  Curated list of resources for the Design of Experiments (DOE)
  ☆37Updated last year
• WardLT / applied-ai-for-materials
  Course materials for "Applied AI for Materials Science and Engineering"
  ☆72Updated 3 years ago
• SergeiVKalinin / MSE_Spring2025
  ☆35Updated 8 months ago
• pyiron / pyiron_atomistics
  pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.
  ☆47Updated this week
• pyiron / pylammpsmpi
  Parallel Lammps Python interface - control a mpi4py parallel LAMMPS instance from a serial python process or a Jupyter notebook - based o…
  ☆36Updated last week
• lamalab-org / llm-tutorial
  Tutorial on LLMs and agents
  ☆29Updated 5 months ago