Haohao Fu

Zhejiang Lab — China

Biochemistry, Genetics and Molecular Biology · Life Sciences

26h-index3.5kcitations93works4.82yr avg
OpenAlex↗ORCID↗Google Scholar↗Lab page↗

Accepting Students?

No reports yet. Know if this professor is taking students?

Research Topics

Protein Structure and Dynamics(37), Enzyme Structure and Function(9), Machine Learning in Materials Science(9), Supramolecular Chemistry and Complexes(8), Spectroscopy and Quantum Chemical Studies(8)

Publications93 total

Prompt Optimization Method Based on Explicit Multi-step Reasoning Paths
Lecture notes in electrical engineering·2026
Node Classification and Link Prediction Methods Based on Hybrid Teacher Models
Lecture notes in electrical engineering·2026
Fine-Tuning Side Chain Substitutions: Impacts on the Lipophilicity–Solubility–Permeability Interplay in Macrocyclic Peptides
Marine Drugs·2025Open Access
One for All, All for One: A Unified Framework for Free-Energy Calculations
Accounts of Chemical Research·2025· 1 cited
Dual-Linear Attention Network for Multi-Object Tracking and Segmentation
Applied Sciences·2025Open Access
Breathing New Life into Classical Force Fields
Communications in Computational Chemistry·2025Open Access
Proton-Resistant Quantum Dots by Ligands
ACS Nano·2025· 1 cited
Calculating Free-Energy Differences Using an Average Force: A Tutorial for Adaptive Biasing Force Simulations
The Journal of Physical Chemistry B·2025
From AI-Driven Sequence Generation to Molecular Simulation: A Comprehensive Framework for Antimicrobial Peptide Discovery
Journal of Chemical Information and Modeling·2025· 1 cited
Aromatic Ring Flips Reveal Reshaping of Protein Dynamics in Crystals and Complexes
2025· 1 citedOpen Access
SpeLL: An Agent for Natural Language-Driven Intelligent Spectral Modeling
Journal of Chemical Information and Modeling·2025· 1 cited
A formally exact method for high-throughput absolute binding-free-energy calculations
Nature Computational Science·2025· 5 citedOpen Access
Rationally Engineering a pH-Low Insertion Peptide Variant Probe for High-Sensitivity Imaging of Early Tumors
ACS Applied Materials & Interfaces·2025· 1 cited
Supramolecular Structure Enabled Photo‐Responsive Charge Transport in Porphyrin‐Based Junctions
Angewandte Chemie International Edition·2025· 4 cited
Supramolecular Structure Enabled Photo‐Responsive Charge Transport in Porphyrin‐Based Junctions
Angewandte Chemie·2025· 1 cited
Zooming across the Alchemical Space
The Journal of Physical Chemistry Letters·2025· 6 citedOpen Access
Accurate Prediction of CRISPR/Cas13a Guide Activity Using Feature Selection and Deep Learning
Journal of Chemical Information and Modeling·2025
High-Coverage Stereoproteome Mapping Uncovers Pervasive Protein Stereoisomerization Associated with Neurodegeneration
Analytical Chemistry·2025· 2 cited
Identification of novel inhibitors for epidermal growth factor receptor tyrosine kinase using absolute binding free-energy simulations
International Journal of Biological Macromolecules·2025· 6 cited
Sialylation Shields Glycoproteins from Oxidative Stress: Mechanistic Insights into Sialic Acid Oxidation and Structural Stability
Journal of the American Chemical Society·2025· 7 cited
page 1 of 5Next →

Frequent Co-authors

Wensheng Cai(38), Xueguang Shao(37), Christophe Chipot(25), Haochuan Chen(9), Han Liu(5), Dai‐Wen Pang(4), François Dehez(3), An‐An Liu(3), Xinlei Chen(3), Yong Li(3), Shuangli Du(3), Zhiyou Zong(3), James C. Gumbart(2), Benoı̂t Roux(2), Zhenya Liu(2), Mingyu Zhang(2), Wei Zhao(2), Hong Zhang(2), Susu Xu(2), Carlee Joe‐Wong(2)