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Hello Yi Xue-- > > Is there anyone who knows how to restart a trajectory in torsional angle > dynamics. I know it is doable in "dynamics verlet" or "dynamics langevin". > But I cannot figure out how to do it for "dynamics internal" which is > torsional angle dynamics included in IVM module. > The IVM doesn't currently have restart capabilities, but it could be added without too much difficulty. I'm curious, though: why is this feature useful for you? best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.9 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8+ <http://mailcrypt.sourceforge.net/> iD8DBQFIvph8PK2zrJwS/lYRArnrAJ9yYg9Hq9T4u/NGjOaBw5luk1JCGwCdGPgI YsMvMnWUsWuk9zxTf5UmJf8= =Nwl5 -----END PGP SIGNATURE-----
