Commit d353289f authored by Alvin Noe Ladines's avatar Alvin Noe Ladines
Browse files

Implemented new nwchem parser

parent 7d4a9061
Pipeline #100570 passed with stages
in 25 minutes and 34 seconds
Subproject commit bd9cd9307d0598f4c9a7bc57f0f469d1f9e8fa34
Subproject commit cf86ec606b7a82e12881af4114989753b22cee77
......@@ -45,6 +45,7 @@ from cp2kparser import CP2KParser
from fhivibesparser import FHIVibesParser
from turbomoleparser import TurbomoleParser
from castepparser import CastepParser
from nwchemparser import NWChemParser
try:
# these packages are not available without parsing extra, which is ok, if the
......@@ -160,13 +161,7 @@ parsers = [
# r'\s+\*\*\*\*\*\* \*\* \*\* \*\* \*\*\*\*\*\*\s+'
)
),
LegacyParser(
name='parsers/nwchem', code_name='NWChem', code_homepage='http://www.nwchem-sw.org/',
parser_class_name='nwchemparser.NWChemParser',
mainfile_contents_re=(
r'Northwest Computational Chemistry Package \(NWChem\) (\d+\.)+\d+'
)
),
NWChemParser(),
LegacyParser(
name='parsers/bigdft', code_name='BigDFT', code_homepage='http://bigdft.org/',
parser_class_name='bigdftparser.BigDFTParser',
......
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