sunchong137

sunchong137's Stars

• sunchong137/snocisd

  Non-orthogonal configuration interaction for molecular systems

  Language:Python4

• MIRALab-USTC/AI4Sci-MiCaM

  This is the code of paper "De Novo Molecular Generation via Connection-aware Motif Mining". Zijie Geng, Shufang Xie, Yingce Xia, Lijun Wu, Tao Qin, Jie Wang, Yongdong Zhang, Feng Wu, Tie-Yan Liu. ICLR 2023.

  Language:Python5210

• sanshar/Dice

  Language:C++4318

• garrettj403/SciencePlots

  Matplotlib styles for scientific plotting

  Language:Python7k708

• tschijnmo/libcanon

  A C++ library for canonicalizing combinatorial objects with lightening speed

  Language:C++42

• fishjojo/pyscfad

  PySCF with auto-differentiation

  Language:C6515

• WagnerGroup/pyqmc

  Python library for real space quantum Monte Carlo

  Language:Python8133

• qpic/qpic

  Creating quantum circuit diagrams in TikZ

  Language:Python15421

• google/googletest

  GoogleTest - Google Testing and Mocking Framework

  Language:C++34.5k10.1k

• hczhai/pyblock

  python3 interface for DMRG code block 1.5.3

  Language:C62

• ayushoriginal/Optimized-RGB-To-ColorName

  This API gives closest approximation of an RGB value to a set of color names. It is highly optimized for performance and scalability.

  Language:Python17528

• pyscf/pyscf

  Python module for quantum chemistry

  Language:Python1.2k567

• SebWouters/CheMPS2

  CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry

  Language:C++7034

• SebWouters/QC-DMET

  QC-DMET: a python implementation of density matrix embedding theory for ab initio quantum chemistry

  Language:Python3726

• gkc1000/pyscf

  Python module for quantum chemistry

  Language:Python21