search

m3g / CellListMap.jl

Flexible implementation of cell lists to map the calculations of particle-pair dependent functions, such as forces, energies, neighbor lists, etc.
https://m3g.github.io/CellListMap.jl/
MIT License
87 stars 4 forks source link

Use cells identical to Gromacs etc. #17

Closed m3g closed 1 year ago

m3g commented 3 years ago

See:

https://github.com/gromacs/gromacs/blob/612a3f43773a0adbc9e86ab1acef48e5f470beb7/src/gromacs/pbcutil/pbc.cpp#L128

lmiq commented 1 year ago

fixed in version 0.8.11