Search

6 results in Authors: Linfeng Zhang

Physical Chemistry

Working Paper

DMFF: An Open-Source Automatic Differentiable Platform for Molecular Force Field Development and Molecular Dynamics Simulation

Xinyan Wang, Jichen Li, Lan Yang, Feiyang Chen, Yingze Wang, Junhan Chang, Junmin Chen, Linfeng Zhang, Kuang Yu

Version 1 posted 24 November 2022

1,320

Downloads

Citations

Theoretical and Computational Chemistry

Working Paper

Uni-Mol: A Universal 3D Molecular Representation Learning Framework

Gengmo Zhou, Zhifeng Gao, Qiankun Ding, Hang Zheng, Hongteng Xu, Zhewei Wei, Linfeng Zhang, Guolin Ke

Version 4 posted 07 March 2023

15,673

Downloads

Citations

Theoretical and Computational Chemistry

Working Paper

Explore the Chemical Space of Linear Alkanes Pyrolysis via Deep Potential Generator

Jinzhe Zeng, Linfeng Zhang, Han Wang, Tong Zhu

Version 1 posted 10 September 2020

1,438

Downloads

Theoretical and Computational Chemistry

Working Paper

Synergistic Application of Molecular Docking and Machine Learning for Improved Protein-Ligand Binding Pose Prediction

He Yang, Hongrui Lin, Yannan Yuan, Yaqi Li, Rongfeng Zou, Gengmo Zhou, Linfeng Zhang, Hang Zheng

Version 1 posted 11 September 2023

503

Downloads

Materials Science

Working Paper

Metal-organic frameworks meet Uni-MOF: a transformer-based gas adsorption detector

Jingqi Wang, Jiapeng Liu, Hongshuai Wang, Guolin Ke, Linfeng Zhang, Jianzhong Wu, Zhifeng Gao, Diannan Lu

Version 2 posted 08 May 2023

1,030

Downloads

Materials Chemistry

Working Paper

Unraveling the Mechanism of Phase Transformation and Structural Evolution in Si Anode with Deep-Potential Molecular Dynamics

Fangjia Fu, Xiaoxu Wang, Linfeng Zhang, Yifang Yang, Jianhui Chen, Bo Xu, Chuying Ouyang, Shenzhen Xu, Fu-Zhi Dai, Weinan E

Version 1 posted 03 January 2023

496

Downloads

Search

Refine Search

6 results in Linfeng Zhang in Authors: Linfeng Zhang

DMFF: An Open-Source Automatic Differentiable Platform for Molecular Force Field Development and Molecular Dynamics Simulation

Uni-Mol: A Universal 3D Molecular Representation Learning Framework

Explore the Chemical Space of Linear Alkanes Pyrolysis via Deep Potential Generator

Synergistic Application of Molecular Docking and Machine Learning for Improved Protein-Ligand Binding Pose Prediction

Metal-organic frameworks meet Uni-MOF: a transformer-based gas adsorption detector

Unraveling the Mechanism of Phase Transformation and Structural Evolution in Si Anode with Deep-Potential Molecular Dynamics

6 results in Authors: Linfeng Zhang