computational-chemistry
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Announcements
| Title | Date |
|---|---|
| Ookami Webinar | 02/14/24 |
| Open Call: Minisymposia for PASC24 | 10/05/23 |
Upcoming Events & Trainings
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Topics from Ask.CI
Knowledge Base Resources
| Title | Category | Tags | Skill Level |
|---|---|---|---|
| CHARMM Links to Install, Run, and Troubleshoot MD Simulations | Learning | charmm, molecular-dynamics, namd, computational-chemistry | Beginner, Intermediate |
| DeepChem | Tool | pytorch, tensorflow, computational-chemistry | Beginner, Intermediate, Advanced |
| Gaussian 16 | Tool | gaussian, computational-chemistry | Intermediate, Advanced |
People with Expertise
Torey Battelle
Arizona State University
Programs
Campus Champions, CCMNet
Roles
mentor, regional facilitator, research computing facilitator, Affinity Group Leader, regional admin, CCMNet PM, CCMNet, CCMNet Admin
Expertise
Gil Speyer
Arizona State University
Programs
ACCESS CSSN, Campus Champions
Roles
mentor, researcher/educator, research computing facilitator, Affinity Group Leader, CIP
Expertise
Paul Rulis
University of Missouri-Kansas City
Programs
Campus Champions
Roles
researcher/educator, research computing facilitator
Expertise
People with Interest
Roy Prouty
University of Maryland, Baltimore County
Programs
At-Large, ACCESS CSSN, Campus Champions
Roles
research computing facilitator, cssn, CIP
Interests
Gil Speyer
Arizona State University
Programs
ACCESS CSSN, Campus Champions
Roles
mentor, researcher/educator, research computing facilitator, Affinity Group Leader, CIP
Interests
Torey Battelle
Arizona State University
Programs
Campus Champions, CCMNet
Roles
mentor, regional facilitator, research computing facilitator, Affinity Group Leader, regional admin, CCMNet PM, CCMNet, CCMNet Admin