. .
Converting chemical file formats
1)The file format representation for crystallographic data. 

2)The OpenBabel component command line utility is used to 

3)The chirality information for the molecules can be found using 

4)The energy of the molecule can be calculated by 

5)Define SMILES 


Cite this Simulator:

..... .....

Copyright @ 2019 Under the NME ICT initiative of MHRD

 Powered by AmritaVirtual Lab Collaborative Platform [ Ver 00.13. ]