예제 #1
0
# standard libraries imports
from __future__ import print_function
import os

# fullrmc library imports
from fullrmc import Engine

# dirname
DIR_PATH = os.path.dirname( os.path.realpath(__file__) )
engineFilePath = os.path.join(DIR_PATH, "engine.rmc")

# load
ENGINE = Engine(path=None)
result, mes = ENGINE.is_engine(engineFilePath, mes=True)
if result:
    ENGINE = ENGINE.load(engineFilePath)
    ENGINE.visualize(foldIntoBox=True, representationParams='VDW 0.1 20')
else:
    print(mes)
예제 #2
0
# standard libraries imports
import os

# fullrmc library imports
from fullrmc import Engine

# dirname
DIR_PATH = os.path.dirname(os.path.realpath(__file__))
engineFilePath = os.path.join(DIR_PATH, "SiOx.rmc")

# load
ENGINE = Engine(path=None)
result, mes = ENGINE.is_engine(engineFilePath, mes=True)
if result:
    ENGINE = ENGINE.load(engineFilePath)
    ENGINE.visualize(boxWidth=0, representationParams="VDW 0.7 100")
else:
    print mes