grimme-lab mstore issues - Githubissues

grimme-lab / mstore

Molecular structure store for testing

Apache License 2.0

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Bump to version 0.3.0

#18 thfroitzheim closed 4 months ago
0
Workflow fix

#17 thfroitzheim closed 4 months ago
0
f-Block test molecules

#16 thfroitzheim closed 5 months ago
0
C and Python API

#15 marvinfriede opened 1 year ago
0
Update install-mod.py

#14 kjelljorner closed 2 years ago
0
replace deprecated `make_directory` with `file(MAKE_DIRECTORY)`

#13 e-kwsm closed 2 years ago
0
Rewrite procedure pointer access

#12 awvwgk closed 2 years ago
0
Allow adjusting of module install subdirectory

#11 awvwgk closed 2 years ago
0
Create module output directory in configure step

#10 awvwgk closed 3 years ago
0
Update dependency handling logic in meson and CMake

#9 awvwgk closed 3 years ago
0
Allow finding of Fortran dependencies in CMake and meson

#8 awvwgk closed 3 years ago
0
misspelled tag "compuational-chemistry"

#7 Beliavsky closed 3 years ago
1
Add CMake build system

#6 awvwgk closed 3 years ago
0
Add draft for CMake build framework

#5 aradi closed 3 years ago
1
Support for CMake build system

#4 awvwgk closed 3 years ago
0
Provide better access to molecule store

#3 awvwgk closed 3 years ago
0
Add ICE10 benchmark set

#2 awvwgk closed 3 years ago
0
Add meta data to fpm package manifest

#1 awvwgk closed 3 years ago
0