gaussian corrdinates to pdb code example
Example: gaussian corrdinates to pdb
babel -ig09 your.log -opdb out.pdb # gaussian optimized corrdinates to pdb
#to install babel fo ubuntu
Step 1
sudo apt-get update -y
Step 2
sudo apt-get install -y babelbabel -ig09 your.log -opdb out.pdb # gaussian optimized corrdinates to pdb
#to install babel fo ubuntu
Step 1
sudo apt-get update -y
Step 2
sudo apt-get install -y babel