- the bulk of the
MOLCAS code was
branched as
open source (LGPL 2.1 license),
under the name
OpenMolcas. The
stable version of
MOLCAS code is distributed...
- Bibcode:2023zndo...7576163W, doi:10.5281/zenodo.7576163 "Order
MOLCAS". "MOPAC has been re-released
under the
open-source LGPL license". Gozem, Samer; Krylov, Anna...
-
RDKit is
open-source
toolkit for cheminformatics. It was
developed by Greg
Landrum with
numerous additional contributions from the
RDKit open source community...
-
since been
modified and extended. In 2007, an
open standard called OpenSMILES was
developed in the
open source chemistry community. The
original SMILES...
- CP2K
Dalton DIRAC DP code
FLEUR FreeON MADNESS MOPAC MPQC
NWChem Octopus OpenMolcas P****C PSI
PyQuante PySCF Quantum ESPRESSO (PWscf) RMG
SIESTA VB2000 YAMBO...
- had betra**** its
leaders ) and La
Resistencia headed by
Ramiro Pozos "El
Molca" who
switched alliances to form a
brief alliance with Los
Zetas (La Resistencia...
- been shattered. Even his own
settlements at
Saratov and
Samara refused to
open their gates to him, and the Don Cossacks,
hearing that the
Patriarch had...
-
software packages MOLPRO,
MOLCAS, ORCA (quantum
chemistry program),
Gaussian (software), TURBOMOLE,
COLUMBUS (needs
MOLCAS),
BAGEL and to user-created...
- into many
quantum chemistry packages,
including NWChem, MOLPRO, UTChem,
MOLCAS, and TURBOMOLE. The GA
library is also
incorporated into sub-surface code...
-
Gabedit is a
graphical user
interface to
GAMESS (US), Gaussian,
MOLCAS, MOLPRO, MPQC,
OpenMopac, PC GAMESS, ORCA and Q-Chem com****tional
chemistry packages...
