对配对抗体语言模型的数据最佳缩放
Mahdi Shafiei Neyestanak1,2, Sarah M Burbach1, Karenna Ng1
1Department of Immunology and Microbiology, The Scripps Research Institute, La Jolla, CA 92037 USA.
bioRxiv : the preprint server for biology
|September 15, 2025
概括
抗体语言模型 (AbLMs) 是数据有限的,与计算受约束的自然语言模型不同. 最佳的AbLM性能需要平衡模型大小和训练数据量,以改善下游任务结果.
科学领域:
- 计算生物学是一种计算生物学.
- 人工智能的人工智能是人工智能.
- 生物信息学是一种生物信息学.
背景情况:
- 大型语言模型 (LLM) 的缩放规律通常假定计算约束.
- 在配对序列上训练的抗体语言模型 (AbLMs) 面临数据限制.
- 这就需要对ABLM进行不同的扩展考虑.
研究的目的:
- 调查模型大小和数据规模对ABLM性能的影响.
- 为了推导出一个特定于AbLM的缩放定律.
- 确定对数据优化ABLMs的数据要求.
主要方法:
- 在5个模型大小和3个训练数据大小中训练了15个ABLM.
- 在下游分类任务上评估了ABLM的绩效.
- 导出了一个AbLM特定的缩放定律.
主要成果:
- AbLM的性能与计算受限的LLM不同,主要是数据受限.
- 显著的性能增长需要足够大的模型尺寸.
- 相当于ESM-2 (650M参数) 的AbLM需要大约550万对抗体序列.
结论:
- 在数据有限的领域,如抗体建模,性能改进取决于模型规模和数据量.
- 目前对自然语言模型的缩放规则并不直接适用于AbLMs.
- 未来的AbLM开发应该专注于优化模型和数据尺度之间的相互作用.
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