Ghemical

Source: Wikipedia, the free encyclopedia.
Ghemical
Developer(s)Ghemical authors
Initial release?
Repository
Written inC++
Operating systemUnix-like
Available in?
TypeComputational chemistry
LicenseGPL
Websitehttp://bioinformatics.org/ghemical

Ghemical is a

MPQC methods based on Hartree–Fock
calculations.

The chemical

OpenBabel, which provides basis functionality like atom typing, rotamer generation and import/export of chemical file formats
.

See also

References

  1. S2CID 5073249
    .

External links