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deepdiff
|
public |
Deep Difference and Search of any Python object/data.
|
2025-03-25 |
|
pybind11
|
public |
Seamless operability between C++11 and Python
|
2025-03-25 |
|
pygau2grid
|
public |
D.G.A. Smith's C-based python module for fast computation of a Gaussian and its derivative on a grid
|
2025-03-25 |
|
hungarian
|
public |
Hungarian/Munkres algorithm for the linear assignment problem, in Python
|
2025-03-25 |
|
snsmp2
|
public |
R. McGibbon's spin-network-scaled MP2 plugin to Psi4
|
2025-03-25 |
|
gau2grid
|
public |
D.G.A. Smith's C library for fast computation of a Gaussian and its derivative on a grid
|
2025-03-25 |
|
pylibefp
|
public |
L. A. Burns's python bindings to libefp
|
2025-03-25 |
|
sphinx-psi-theme
|
public |
theme for Psi4 Sphinx docs, derived from Cloud
|
2025-03-25 |
|
bfdb-jupyter
|
public |
No Summary
|
2025-03-25 |
|
ci-psi4
|
public |
a continuous integration offset download counter for Psi4
|
2025-03-25 |
|
ci-psi4-lt
|
public |
a continuous integration offset download counter for Psi4 link-time libraries
|
2025-03-25 |
|
lawrap
|
public |
Thin C and C++ wrappers around the Fortran BLAS and LAPACK interfaces, meant to simplify usage and increase robustness while maintaining as low-level an interface as possible
|
2025-03-25 |
|
gnu
|
public |
No Summary
|
2025-03-25 |
|
sse41
|
public |
No Summary
|
2025-03-25 |
|
qcdb
|
public |
No Summary
|
2025-03-25 |
|
psi4-dev
|
public |
Development support for Psi4
|
2025-03-25 |
|
psi4-lt-mp
|
public |
link-time quantum chemistry add-ons for Psi4
|
2025-03-25 |
|
psi4-rt
|
public |
Optional run-time add-ons to Psi4
|
2025-03-25 |
|
am7
|
public |
metapackage tracking feature Libint MAX_AM_ERI=7
|
2025-03-25 |
|
am8
|
public |
metapackage tracking feature Libint MAX_AM_ERI=8
|
2025-03-25 |
|
simint
|
public |
B. Pritchard's vectorized Obara-Saika electron repulsion integrals
|
2025-03-25 |
|
erd
|
public |
N. Flocke and V. Lotrich's Gaussian molecular integrals for AcesIII
|
2025-03-25 |
|
gcc-5-mp
|
public |
gcc-5 metapackage including pinned dependencies
|
2025-03-25 |
|
libxc
|
public |
M.A.L. Marques's exchange-correlation functionals for density-functional theory
|
2025-03-25 |
|
gcc-5
|
public |
The GNU Compiler Collection
|
2025-03-25 |
