CCL: Announcement: Materials Studio 5.0 Release
- From: "Stephen Todd" <stodd-.-accelrys.com>
- Subject: CCL: Announcement: Materials Studio 5.0 Release
- Date: Mon, 2 Nov 2009 13:16:50 -0500
Sent to CCL by: "Stephen Todd" [stodd[A]accelrys.com]
I am pleased to announce the release of Materials Studio 5.0. New functionality
in this release includes:
* Parallelized versions of Forcite Plus and Mesocite for classical simulations
of atoms and beads
* Mesocite now includes a parallel implementation of dissipative particle
dynamics for simulations of soft matter
* A new Amorphous Cell which enables building of any type of amorphous
structure, including the capabilities to constrain packing to defined volumes
and improved treatment of flexible torsions and ring spearing.
* CASTEP, our plane-wave DFT code, can now compute Raman intensities, has
improved spectra display for core level spectra, and includes the new PBEsol
gradient corrected density functional.
* Improved forcefield support, periodic QMPot, and vibrational frequencies for
QM/MM calculations using QMERA
* Extensions to the AM1* semi-empirical hamiltonian in VAMP
* Much much more...
Interested in finding out more? Attend one of our webinars:
http://accelrys.com/events/webinars/materials-studio-50/index.html
Best regards,
Stephen Todd, Senior Product Manager, Materials Studio