Affinity Groups

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Account and Access Management CI Facilitators A group for CI and RCD professionals responsible for developing and maintaining the Account and Access Management solutions used at their institutions. Participants are invited to share and discuss… allocation-managementadministering-hpc Login to join
hpc.social High Performance Computing and related fields, including Big Data, Research Computing, and related hardware and software optimized for these fields, including research software engineering and… administering-hpccluster-managementcluster-support +6 more tags Login to join
Open OnDemand An intuitive, innovative, and interactive interface to remote computing resources.Open OnDemand helps computational researchers and students efficiently utilize remote computing resources by making… open-ondemandadministering-hpccluster-management +4 more tags Login to join

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Engagements

Re-engineering Lilly’s KisunlaTM into a novel antibody targeting IL13RA2 against GBM using AI-driven macromolecular modeling
Atrium Health Levine Cancer
  • Summary and objectives of the proposed experiments: 
  1. An initial research-based Ab (scFv47, discovered by our collaborator Dr. Balyasnikova) model, modeling Ab-Ag (IL13RA2 against GBM) protein complex, and identifying the binding sites (epitopes) using ROSETTA and AlphaFold2 multimer tools.
  2. Graft the CDRs of scFv (single-chain variable fragment) of antibody or Bispecific T cell engagers (BTEs) onto the template Ab, the framework of Lilly's Kisunla™ Ab drug.
  3. Modify, improve, and optimize the overall or full antibody protein structures using AI-driven macromolecule modeling (AlphaFold3).
  4. Explore single nucleotide polymorphism (SNP), pathogenic genetic variants and N-glycosylation of IL13RA2 (target) protein domain interacting with the Ab candidates among the patient population using ROSETTA software packages.
Status: Recruiting

People with Expertise

Chad Julius

South Dakota State University

Programs

Campus Champions, Great Plains

Roles

mentor, research computing facilitator

Expertise

Christina Divoll

Tufts University

Programs

Campus Champions, ACCESS CSSN

Roles

research computing facilitator

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Expertise

Ruben Lara

Georgia Institute of Technology

Programs

Campus Champions

Roles

ci systems engineer

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Expertise

People with Interest

Christopher Maher

University of North Carolina at Charlotte

Programs

Campus Champions

Roles

research computing facilitator

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Interests

Michael Weiner

Georgia Institute of Technology

Programs

Campus Champions

Roles

CampusChampionsAdmin, research computing facilitator, Affinity Group Leader

Michael Weiner

Interests

Sapana Soni

LBNL

Programs

CCMNet

Roles

CCMNet

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Interests