Fangqiang Zhu

According to our database, Fangqiang Zhu authored at least 12 papers between 2006 and 2021.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2021

High-throughput virtual screening of small molecule inhibitors for SARS-CoV-2 protein targets with deep fusion models.

Garrett A. Stevenson, Derek Jones, Hyojin Kim, W. F. Drew Bennett, Brian J. Bennion, Monica Borucki, Feliza Bourguet, Aidan Epstein, Magdalena Franco, Brooke Harmon, Stewart He, Max P. Katz, Daniel A. Kirshner, Victoria Lao, Edmond Y. Lau, Jacky Lo, Kevin McLoughlin, Richard Mosesso, Deepa K. Murugesh, Oscar A. Negrete, Edwin A. Saada, Brent Segelke, Maxwell Stefan, Marisa W. Torres, Dina Weilhammer, Sergio Ernesto Wong, Yue Yang, Adam T. Zemla, Xiaohua Zhang, Fangqiang Zhu, Felice C. Lightstone, Jonathan E. Allen

Proceedings of the International Conference for High Performance Computing, 2021

2020

Binding Affinity Prediction by Pairwise Function Based on Neural Network.

Fangqiang Zhu, Xiaohua Zhang, Jonathan E. Allen, Derek Jones, Felice C. Lightstone

J. Chem. Inf. Model., 2020

2019

Calculating Single-Channel Permeability and Conductance from Transition Paths.

Xiaoyan Zhou, Fangqiang Zhu

J. Chem. Inf. Model., 2019

2017

Parameter Optimization for Interaction between C-Terminal Domains of HIV-1 Capsid Protein.

Hao Sha, Fangqiang Zhu

J. Chem. Inf. Model., 2017

2015

Monte Carlo Simulations of HIV Capsid Protein Homodimer.

Fangqiang Zhu, Bo Chen

J. Chem. Inf. Model., 2015

2012

Convergence and error estimation in free energy calculations using the weighted histogram analysis method.

Fangqiang Zhu, Gerhard Hummer

J. Comput. Chem., 2012

2009

A Self-Organizing Algorithm for Modeling Protein Loops.

Pu Liu, Fangqiang Zhu, Dmitrii N. Rassokhin, Dimitris K. Agrafiotis

PLoS Comput. Biol., 2009

Conformational Analysis of Macrocycles: Finding What Common Search Methods Miss.

Pascal Bonnet, Dimitris K. Agrafiotis, Fangqiang Zhu, Eric J. Martin

J. Chem. Inf. Model., 2009

2007

Recursive Distance Partitioning Algorithm for Common Pharmacophore Identification.

Fangqiang Zhu, Dimitris K. Agrafiotis

J. Chem. Inf. Model., 2007

Conformational Sampling of Bioactive Molecules: A Comparative Study.

Dimitris K. Agrafiotis, Alan C. Gibbs, Fangqiang Zhu, Sergei Izrailev, Eric J. Martin

J. Chem. Inf. Model., 2007

Self-organizing superimposition algorithm for conformational sampling.

Fangqiang Zhu, Dimitris K. Agrafiotis

J. Comput. Chem., 2007

2006

A distance geometry heuristic for expanding the range of geometries sampled during conformational search.

Sergei Izrailev, Fangqiang Zhu, Dimitris K. Agrafiotis

J. Comput. Chem., 2006