From owner-chemistry@ccl.net Thu May 30 19:09:00 2013
From: "Mathew D Halls Mat.Halls__schrodinger.com" <owner-chemistry{}server.ccl.net>
To: CCL
Subject: CCL: Schrdinger's Materials Science Suite 1.0 is released
Message-Id: <-48752-130530190818-18289-3pQONdqB7N1etahMbeXfJw{}server.ccl.net>
X-Original-From: "Mathew D Halls" <Mat.Halls++schrodinger.com>
Date: Thu, 30 May 2013 19:08:16 -0400


Sent to CCL by: "Mathew D Halls" [Mat.Halls#,#schrodinger.com]
Dear Colleague, 

Im pleased to announce the debut of Schrdinger's Materials Science Suite 
providing versatile and powerful tools for the analysis and optimization of 
chemical systems through atomic-scale simulation.

The Materials Science Suite delivers innovative, robust, and scientifically 
validated molecular modeling and simulation methods through an easy-to-use 
and intuitive interface.

Some highlights include: 

* High-performance first-principles calculations in gas phase and in solution
* Classical simulations with implicit or explicit solvents
* Organometallic complex builders and chemical library enumeration
* Virtual screening on intrinsic properties and energetics
* Property based panels and workflows for applications such as organic 
semiconductors and reactive precursors
* Vibrational and electronic spectra for complex systems
* Reliable properties for transition metal containing systems
* Custom scripting through an extensive Python API
* GUI designed to streamline complex workflows
* Plotting, visual data mining and filtering within a unified graphical user 
interface that serves all computations

Please visit our web site to learn more about the Materials Science Suite 
1.0.

http://www.schrodinger.com/productsuite/3/

We are excited about the Materials Science Suite and look forward to 
discussing with you the impact that our tools can have on your research.


Best regards,

Mathew D. Halls, Ph.D.
Director of Materials Science