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

Transient Poly(ADP-Ribose) Triggers FUS Condensation Hysteresis via a Prion-Like Mechanism.

瞬态聚(ADP-核糖)通过类似朊病毒的机制触发FUS缩合滞后

Liu Hongrui, Cai Yuxuan, Shi Leilei, Pillai Meenakshi, Das Nilimesh, Tarbox Haley E, Ge Yingda, Yue Kun, Yang Xingyi, Rath Piyush, Badiee Mohsen, Fabilane Charina S, Spangler Jamie B, Bedford Mark T, Myong Sua, Fried Stephen D, Ding Xinqiang, Leung Anthony K L

Bayesian Multistate Bennett Acceptance Ratio Methods

贝叶斯多状态Bennett接受率方法

Ding, Xinqiang

CHARMM at 45: Enhancements in Accessibility, Functionality, and Speed

CHARMM 45周年:可访问性、功能性和速度方面的提升

Hwang, Wonmuk; Austin, Steven L; Blondel, Arnaud; Boittier, Eric D; Boresch, Stefan; Buck, Matthias; Buckner, Joshua; Caflisch, Amedeo; Chang, Hao-Ting; Cheng, Xi; Choi, Yeol Kyo; Chu, Jhih-Wei; Crowley, Michael F; Cui, Qiang; Damjanovic, Ana; Deng, Yuqing; Devereux, Mike; Ding, Xinqiang; Feig, Michael F; Gao, Jiali; Glowacki, David R; Gonzales, James E 2nd; Hamaneh, Mehdi Bagerhi; Harder, Edward D; Hayes, Ryan L; Huang, Jing; Huang, Yandong; Hudson, Phillip S; Im, Wonpil; Islam, Shahidul M; Jiang, Wei; Jones, Michael R; Käser, Silvan; Kearns, Fiona L; Kern, Nathan R; Klauda, Jeffery B; Lazaridis, Themis; Lee, Jinhyuk; Lemkul, Justin A; Liu, Xiaorong; Luo, Yun; MacKerell, Alexander D Jr; Major, Dan T; Meuwly, Markus; Nam, Kwangho; Nilsson, Lennart; Ovchinnikov, Victor; Paci, Emanuele; Park, Soohyung; Pastor, Richard W; Pittman, Amanda R; Post, Carol Beth; Prasad, Samarjeet; Pu, Jingzhi; Qi, Yifei; Rathinavelan, Thenmalarchelvi; Roe, Daniel R; Roux, Benoit; Rowley, Christopher N; Shen, Jana; Simmonett, Andrew C; Sodt, Alexander J; Töpfer, Kai; Upadhyay, Meenu; van der Vaart, Arjan; Vazquez-Salazar, Luis Itza; Venable, Richard M; Warrensford, Luke C; Woodcock, H Lee; Wu, Yujin; Brooks, Charles L 3rd; Brooks, Bernard R; Karplus, Martin

Fast free energy estimates from λ-dynamics with bias-updated Gibbs sampling

利用偏差更新的吉布斯采样,从λ动力学中快速估算自由能

Robo, Michael T; Hayes, Ryan L; Ding, Xinqiang; Pulawski, Brian; Vilseck, Jonah Z

Transferable Implicit Solvation via Contrastive Learning of Graph Neural Networks

基于图神经网络对比学习的可迁移隐式求解

Airas, Justin; Ding, Xinqiang; Zhang, Bin

OpenABC enables flexible, simplified, and efficient GPU accelerated simulations of biomolecular condensates

OpenABC 能够实现灵活、简化且高效的 GPU 加速生物分子凝聚体模拟。

Liu, Shuming; Wang, Cong; Latham, Andrew P; Ding, Xinqiang; Zhang, Bin

Transferable Coarse Graining via Contrastive Learning of Graph Neural Networks

基于对比学习的图神经网络的可迁移粗粒化

Airas, Justin; Ding, Xinqiang; Zhang, Bin

OpenABC Enables Flexible, Simplified, and Efficient GPU Accelerated Simulations of Biomolecular Condensates

OpenABC 实现了生物分子凝聚体的灵活、简化和高效的 GPU 加速模拟

Liu, Shuming; Wang, Cong; Latham, Andrew; Ding, Xinqiang; Zhang, Bin

Contrastive Learning of Coarse-Grained Force Fields

粗粒化力场的对比学习

Ding, Xinqiang; Zhang, Bin

Generalizing the Discrete Gibbs Sampler-Based λ-Dynamics Approach for Multisite Sampling of Many Ligands

将基于离散吉布斯采样器的λ动力学方法推广到多配体多位点采样

Vilseck, Jonah Z; Ding, Xinqiang; Hayes, Ryan L; Brooks, Charles L 3rd