pyqmmm.md.bfactor_adder¶
Functions
Main function to execute the script. |
|
Identify the only .csv and .pdb files in the current directory. |
|
|
Update the b-factors in a pdb file and write to a new file using data from a .csv file. |
Functions
Main function to execute the script. |
|
Identify the only .csv and .pdb files in the current directory. |
|
|
Update the b-factors in a pdb file and write to a new file using data from a .csv file. |