| 项目编号 |
PRJCA034454 |
| 项目标题 |
In silico design of high-affinity antigenic peptides for HLA-B44 |
| 涉及领域 |
Medical |
| 数据类型 |
Proteome
|
| 物种名称 |
Homo sapiens
|
| 描述信息 |
Cancer cell-killing by CD8+ T cells demands effective tumor antigen presentation by human leukocyte antigen class I (HLA-I) molecules. Screening and designing highly immunogenic neoantigens require quantitative computations to reliably predict HLA-peptide binding affinities. Here, with all-atom molecular dynamics (MD) simulations and free energy perturbation (FEP) methods, we design a collection of antigenic peptide candidates through in silico mutagenesis studies on immunogenic neoantigens. |
| 样品范围 |
Single molecule |
| 发布日期 |
2025-01-22 |
| 出版信息 |
|
| 项目资金来源 |
| 机构 |
项目类型 |
授权项目ID |
授权项目名称 |
| Ministry of Science and Technology of the People's Republic of China (MOST)
|
National Key Technologies R&D Program
|
2021YFF1200404
|
Molecular Dynamics Simulation and High-Precision Structural Refinement Research
|
|
|
| 提交者 |
Ruhong
Zhou (rhzhou@zju.edu.cn)
|
| 提交单位 |
Zhejiang University |
| 提交日期 |
2025-01-01 |
