Christophe Chipot - Publications, H-index & Citations

Christophe Chipot

Université de Lorraine

62H指数

334论文数

3.4W被引数

收录论文 165

发表时间

Breaking timescales with generative sampling of conformational transitions 通过生成采样打破构象转变的时间尺度

Nature

IF48.5

2026-09-09

PREAI

Chenyu Tang; Mayank Prakash Pandey; Cheng Giuseppe Chen; Alberto Megías; François Dehez; Christophe Chipot

At the Cutting Edge of Theoretical and Computational Biophysics 理论生物物理学的前沿

Journal of Physical Chemistry B

IF2.9

2026-08-20

PREAI

Christophe Chipot; Gregory Voth; Joan-Emma Shea

Good Practices for Simulation Studies Published in The Journal of Physical Chemistry B 《物理化学杂志B》中模拟研究的良好实践

The Journal of Physical Chemistry B

IF2.9

2026-06-18

OAAI

Christophe Chipot; Jiali Gao; Benoît Roux; Ali A. Hassanali; Barbara Kirchner; Joan-Emma Shea

Convergence is not correctness: context-dependent performance of enhanced-sampling methods across biological complexity 收敛不等于正确性：增强采样方法在生物复杂性中的上下文依赖性能

Nature Communications

IF15.7

2026-06-12

OAAI

Christopher Kang; Cheng Giuseppe Chen; Chenyu Tang; Sergio Contreras Arredondo; Mengchen Zhou; Haohao Fu; Lan Yang; James C. Gumbart; Ashkan Fakharzadeh; Mahmoud Moradi; Haochuan Chen; Rui Sun; Jonathan Harris; Benoît Roux; Christophe Chipot

Aromatic ring flips reveal reshaping of protein dynamics in crystals and complexes 芳香环翻转揭示晶体和复合物中蛋白质动力学的重塑

Nature Chemistry

IF20.2

2026-06-10

OAAI

Lea M. Becker; Haohao Fu; Ben P. Tatman; Matthias Dreydoppel; Anna Kapitonova; Daniel M. Balazs; Ulrich Weininger; Sylvain Engilberge; Christophe Chipot; Paul Schanda

Free-Energy Landscapes of HBV Hexamer Closure Reveal Key Structural Features of the Transition HBV六聚体闭合的自由能景观揭示了过渡态的关键结构特征

Journal of Chemical Theory and Computation

IF5.5

2026-05-04

OAAI

Zixing Fan; Anna Pavlova; Diane L. Lynch; Christophe Chipot; James C. Gumbart

Correction to “One for All; All for One: A Unified Framework for Free-Energy Calculations”对“One for All; All for One: A Unified Framework for Free-Energy Calculations”的修正

Accounts of Chemical Research

IF17.7

2026-04-07

PREAI

Mengchen Zhou; Xuyang Liu; Xueguang Shao; Christophe Chipot; Wensheng Cai; Haohao Fu

Learning the committor without collective variables 学习不依赖集体变量的提交者函数

Nature Computational Science

IF18.3

2026-02-17

PREAI

Sergio Contreras Arredondo; Chenyu Tang; Radu A. Talmazan; Alberto Megías; Cheng Giuseppe Chen; Christophe Chipot

GPU-Accelerated Implementation of Constant-pH Molecular Dynamics in NAMD NAMD中恒定pH分子动力学的GPU加速实现

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2025-12-01

PREAI

Moe, Sarah; Chipot, Christophe; Roux, Benoit

Calculating Free-Energy Differences Using an Average Force: A Tutorial for Adaptive Biasing Force Simulations 利用平均力计算自由能差异：自适应偏置力模拟教程

JOURNAL OF PHYSICAL CHEMISTRY B

IF2.9

2025-09-01

PREAI

Talmazan, Radu A.; Fu, Haohao; Zhou, Mengchen; Henin, Jerome; Gumbart, James C.; Chipot, Christophe

Simulating Biomolecules with the Variable Protonation State: A Tutorial for Constant-pH Molecular Dynamics in NAMD 模拟可变质子化状态的生物分子：NAMD中恒定pH分子动力学的教程

The Journal of Physical Chemistry B

IF0

2025-08-04

PREAI

Sarah Moe; Brian K. Radak; Christophe Chipot; Benoît Roux

In Memoriam: Professor Andrzej (Andrew) Pohorille (May 14; 1949; to January 6; 2024): A Legacy in Astrobiology and Computational Science 纪念：Andrzej (Andrew) Pohorille 教授（1949年5月14日—2024年1月6日）：在 astrobiology 和 computational science 领域的遗产

Astrobiology

IF2.6

2025-07-17

PREAI

Fathi Karouia; Michael Wilson; Karl Schweighofer; Christophe Chipot; Tori Hoehler; Joanna Sokolowska

Iterative variational learning of committor-consistent transition pathways using artificial neural networks 使用人工神经网络对commitor一致的过渡路径进行迭代变分学习

Nature Computational Science

IF18.3

2025-06-30

PREAI

Alberto Megías; Sergio Contreras Arredondo; Cheng Giuseppe Chen; Chenyu Tang; Benoît Roux; Christophe Chipot

Structural dynamics and permeability of the TRPV3 pentamer TRPV3五聚体的结构动力学与渗透性

NATURE COMMUNICATIONS

IF15.7

2025-05-15

OAAI

Lansky, Shifra; Wang, Zhaokun; Clarke, Oliver B.; Chipot, Christophe; Scheuring, Simon

Probing the orientation and membrane permeation of rhodamine voltage reporters through molecular simulations and free energy calculations

JOURNAL OF MATERIALS CHEMISTRY B

IF5.7

2025-01-01

PREAI

Qi, Yajing; Fung, Lap Yan; Chipot, Christophe; Wang, Yi

Isoleucine gate blocks K+ conduction in C-type inactivation 异亮氨酸门阻断C型失活中的K传导

ELIFE

IF0

2024-11-12

OAAI

Treptow, Werner; Liu, Yichen; Bassetto, Carlos A. Z.; Pinto, Bernardo I.; Alves Nunes, Joao Antonio; Mendoza Uriarte, Ramon; Chipot, Christophe J.; Bezanilla, Francisco; Roux, Benoit

Boosting Enzyme Activity in Biomass Conversion by Modulating the Hydrolysis Process of Cellobiohydrolases

ACS CATALYSIS

IF13.1

2024-10-16

PREAI

Liu, Han; Ding, Yu; Mazurkewich, Scott; Pei, Wenwen; Wei, Xiuxin; Larsbrink, Johan; Chipot, Christophe; Hong, Zhangyong; Cai, Wensheng; Zong, Zhiyou

Elucidation of the noncovalent interactions driving enzyme activity guides branching enzyme engineering for α-glucan modification

NATURE COMMUNICATIONS

IF15.7

2024-10-09

OAAI

Zong, Zhiyou; Zhang, Xuewen; Chen, Peng; Fu, Zhuoyue; Zeng, Yan; Wang, Qian; Chipot, Christophe; Leggio, Leila Lo; Sun, Yuanxia