PTEROSOR/QUESTDB_website
10
0
Fork 0
mirror of https://github.com/LCPQ/QUESTDB_website.git synced 2024-07-23 03:07:44 +02:00
Code Releases Activity

Add support for unsafe data in Line format

Browse Source
This commit is contained in:
Mickaël Véril 2019-12-17 12:49:02 +01:00
parent 0cef9b8935
commit 464923c04b
1 changed files with 6 additions and 1 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

7
tools/lib/data.py
View File

@ -1,6 +1,7 @@
from collections import OrderedDict
from TexSoup import TexSoup
from .LaTeX import newCommand
from TexSoup import TexNode
from enum import IntEnum,auto,unique,IntFlag
from .Format import Format
import re
@ -77,7 +78,11 @@ class dataFileBase(object):
datacls=dict()
for index,cell in enumerate(col[3:]):
if str(cell)!="":
unsafe=False
val= list(cell.contents)[0]
if type(val) is TexNode and val.name=='emph':
unsafe=True
val=val.string
val=float(str(val))
finst=finsts[index]
dt=finst[1]
@ -89,7 +94,7 @@ class dataFileBase(object):
datacls[dt]=data
data.molecule=mymolecule
data.method=mymethod
data.excitations.append(excitationValue(firstState,finst[0],val,type=finst[2],isUnsafe=False))
data.excitations.append(excitationValue(firstState,finst[0],val,type=finst[2],isUnsafe=unsafe))
datalist.append(data)
return datalist
elif format==Format.COLUMN: