Predicting HLA-peptide complex immunogenicity with molecular dynamics and graph convolutional deep learning
- 2022
- ACS Fall 2022
Publications
This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.
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30 results for Jeff Weber
Molecular dynamics as a data source: scaling simulation for building AI models
- Joseph Morrone
- Jeff Weber
- et al.
- 2023
- ACS Fall 2023
Combining molecular simulation and AI for antibody design against cancer immunotherapy targets
- 2023
- ACS Fall 2023
Graph-based 3D Generative Small-Molecule Modeling Targeting for Multi Proteins with Enhanced Binding Compatibility
- Seung Gu Kang
- Jeff Weber
- et al.
- 2023
- ACS Fall 2023
Molecular basis of differential HLA class I-restricted T cell recognition of a highly networked HIV peptide
- Xiaolong Li
- Nishant Kumar Singh
- et al.
- 2023
- Nature Communications
Phosphatidylserine-induced conformational modulation of immune cell exhaustion-associated receptor TIM3
- Jeffrey K. Weber
- Ruhong Zhou
- 2017
- Scientific Reports
PEGylated graphene oxide elicits strong immunological responses despite surface passivation
- Nana Luo
- Jeffrey K. Weber
- et al.
- 2017
- Nature Communications
Graphene-Induced Pore Formation on Cell Membranes
- Guangxin Duan
- Yuanzhao Zhang
- et al.
- 2017
- Scientific Reports
Folding and Stabilization of Native-Sequence-Reversed Proteins
- Yuanzhao Zhang
- Jeffrey K. Weber
- et al.
- 2016
- Scientific Reports
Single-Walled Carbon Nanotubes Inhibit the Cytochrome P450 Enzyme, CYP3A4
- Ramy El-Sayed
- Kunal Bhattacharya
- et al.
- 2016
- Scientific Reports