日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

Ab initio prediction of RNA structure ensembles with RNAnneal

利用 RNAnneal 从头预测 RNA 结构集合

Herron, Lukas; Qiu, Yunrui; Verma, Anjali; Sreyas Adury, Venkata Sai; John, Richard; Lee, Suemin; Mehdi, Shams; Sanwal, Disha; Schneekloth, John S Jr; Tiwary, Pratyush

Generative AI for computational chemistry: A roadmap to predicting emergent phenomena

计算化学中的生成式人工智能:预测涌现现象的路线图

Tiwary, Pratyush; Herron, Lukas; John, Richard; Lee, Suemin; Sanwal, Disha; Wang, Ruiyu

Using Time Dependent Rate Analysis to Evaluate the Quality of Machine Learned Reaction Coordinates for Biasing and Computing Kinetics

利用时变速率分析评估机器学习反应坐标的质量,以进行动力学偏置和计算

Mazzaferro, Nicodemo; Lee, Suemin; Cossio, Pilar; Tiwary, Pratyush; Hocky, Glen M

Skin irritation testing using human iPSCs derived 3D skin equivalent model.

利用人诱导多能干细胞衍生的3D皮肤等效模型进行皮肤刺激性测试

Shin Hyewon, Kim Se-Eun, Kim C-Yoon, Lee Suemin, Lee Ji-Heon, Baek Jieun, Chung Gujin, Kim Min Woo, Oh Jeong-Seop, Park Shinhye, Lee Yun Hyeong, Jeong Youngin, Park Jeong Hwan, Kim Yoonseo, Lee Myeonghee, Lee Seul-Gi, Chung Hyung Min

Calculating Protein-Ligand Residence Times through State Predictive Information Bottleneck Based Enhanced Sampling

基于状态预测信息瓶颈的增强采样计算蛋白质-配体停留时间

Lee, Suemin; Wang, Dedi; Seeliger, Markus A; Tiwary, Pratyush

Calculating Protein-Ligand Residence Times Through State Predictive Information Bottleneck based Enhanced Sampling

基于状态预测信息瓶颈的增强采样计算蛋白质-配体停留时间

Lee, Suemin; Wang, Dedi; Seeliger, Markus A; Tiwary, Pratyush

Modeling selectivity of antimicrobial peptides: how it depends on the presence of host cells and cell density

抗菌肽选择性建模:它如何取决于宿主细胞的存在和细胞密度

Lee, Suemin; Schefter, Bethany R; Taheri-Araghi, Sattar; Ha, Bae-Yeun

The effects of backpack loads and spinal stabilization exercises on the dynamic foot pressure of elementary school children with idiopathic scoliosis

背包负重和脊柱稳定练习对患有特发性脊柱侧弯的小学生动态足底压力的影响

Lee, Suemin; Shim, Jemyung