The utility pdb2adf

Starting from the adf2005.01 version the utility pdb2adf is available in the official release. This utility creates an ADF input file from a PDB file, for a subsequent QM/MM calculation using ADF. This tool has been developed by Marcel Swart. Previously this utility could be found in the contributed software page. Starting from adf2008.01 there is support for the NEWQMMM subkey.

SCM Home Page
Quality Software. Quantum Science
*
*
85.10.201.17
Copyright Terms of UsePrivacy Policy
Home Products Try & Buy Downloads Documentation Support Highlights News About SCM Contact
Home     Products     Try & Buy     Downloads     Documentation     Support     Highlights     News     About SCM     Contact