Bioscience Computing

Accelrys GCG software FAQ
ID: 4229 | Description: This document gives a brief description of Accelrys GCG (an integrated comprehensive sequence analysis package consisting of over 130 programs) and addresses some of the more frequently asked questions concerning the software package.
Genre: Tutorial | Last Modified: 2008-06-23 | Audience: Everyone

Gaussian: Tutorial on Converting Brookhaven Protein Data Bank (PDB) Files to Gaussian Input Files
ID: 803 | Description: This document examines how to convert a molecular structure described in Brookhaven Protein Data Bank (PDB) file format to a Gaussian input file using the NewZmat command.
Genre: Tutorial | Last Modified: 2008-06-18 | Audience: Everyone

Gaussian: Tutorial on Using LSF Scripts to Automate Jobs
ID: 806 | Description: This document describes how to make use of LSF script to automate Gaussian jobs for relatively big molecules.
Genre: Tutorial | Last Modified: 2008-06-18 | Audience: Everyone

Gaussian: Tutorial on Water Single Point Energy and Scripts
ID: 805 | Description: This document describes the steps for writing a script to create and save a Gaussian file based on restricted Hartree-Fock calculations on a 6-31G(d) basis set for water single point energy.
Genre: Tutorial | Last Modified: 2008-06-18 | Audience: Everyone

Gaussian: Tutorial on Water Single Point Energy and the Command Line
ID: 807 | Description: This document describes how to do command line execution to create and save a Gaussian file based on restricted Hartree-Fock calculations on a 6-31G(d) basis set for water single point energy.
Genre: Tutorial | Last Modified: 2008-06-18 | Audience: Everyone

How to restart a Gaussian Run
ID: 4520 | Description: This document describes how to restart prematurely terminated Gaussian calculations by using the Gaussian supported checkpointing file.
Genre: Tutorial | Last Modified: 2007-06-25 | Audience: Everyone

Invoking AVS/Express on Emerald via UNIX Desktop (SGI, SUN, Linux, etc.)
ID: 6180 | Description: This document describes how to invoke the Visualization Application AVS/Express on the research computing server Emerald with a UNIX Desktop computer.
Genre: Tutorial | Last Modified: 2008-07-14 | Audience: Everyone

Invoking AVS/Express on Emerald via Windows Desktop with X-Win32
ID: 6181 | Description: This document describes how to invoke the Visualization Application AVS/Express on the research computing server Emerald with a Windows Desktop machine using X-Win32
Genre: Tutorial | Last Modified: 2008-07-14 | Audience: Everyone

Invoking CNSsolve on Emerald
ID: 6173 | Description: This document describes how to invoke the Scientific Application CNSsolve on the Research Computing server Emerald.
Genre: Tutorial | Last Modified: 2008-07-09 | Audience: Everyone

Invoking CPMD on Emerald
ID: 6174 | Description: This document describes how to invoke the Scientific Application CPMD on the Research Computing server Emerald.
Genre: Tutorial | Last Modified: 2008-07-09 | Audience: Everyone

Invoking ECCE on Emerald via UNIX Desktop (SGI, SUN, Linux, etc.)
ID: 6205 | Description: This document describes how to invoke the Visualization Application ECCE on the research computing server Emerald with a UNIX Desktop computer.
Genre: Tutorial | Last Modified: 2008-07-10 | Audience: Everyone

Invoking ECCE on Emerald via Windows Desktop with X-Win32
ID: 6207 | Description: This document describes how to invoke the Visualization Application ECCE on the research computing server Emerald with a Windows Desktop machine using X-Win32
Genre: Tutorial | Last Modified: 2008-07-10 | Audience: Everyone

Invoking GaussView on Emerald via UNIX Desktop (SGI, SUN, Linux, etc.)
ID: 6208 | Description: This document describes how to invoke the Visualization Application GaussView on the Research Computing server Emerald via a UNIX desktop computer.
Genre: Tutorial | Last Modified: 2008-07-10 | Audience: Everyone

Invoking GaussView on Emerald via Windows Desktop with X-Win32
ID: 6215 | Description: This document describes how to invoke the Visualization Application GaussView on the Research Computing server Emerald using a Windows desktop machine with X-Win32
Genre: Tutorial | Last Modified: 2008-07-10 | Audience: Everyone

Invoking Molden on Emerald via UNIX Desktop (SGI, SUN, Linux, etc.)
ID: 6227 | Description: This document describes how to invoke the Visualization Application Molden on the Research Computing server Emerald using a UNIX desktop computer.
Genre: Tutorial | Last Modified: 2008-07-10 | Audience: Everyone

• Administrative (Remedy, Financial)
• Advanced Computing (Research, Statistics)
  • Bioscience Computing
  • Geographic Information Systems
  • Mass Storage
  • Math and Statistics
• Blackboard (Educational Technology)
• Campus Information (Calendars, Directories)
• Communication (Phones, Conferencing)
• Data Storage (Backup, Recovery)
• Email (Lists, Webmail)
• Networking (Wireless, VPN)
• Security (Policy, Viruses)
• Software (MS Office, Operating Systems)
• Support (Laptops, Printing)
• Web (Browsers, Web Design)