[AMBER] Use of DFTB3 with Dispersion Correction

From: Christian Wiebeler <christian.wiebeler.mail.huji.ac.il>
Date: Sun, 23 Jul 2017 20:36:21 +0300

Dear AMBER Developers,

Thanks a lot for the implementation of DFTB3 in AmberTools17! Is there a
way of using dispersion correction for DFTB3, for example similar to the
case of DFTB2?

Best regards,
Christian

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Sun Jul 23 2017 - 11:00:03 PDT
Custom Search