Hongmao Sun

发表

Table 8, Stepwise protocol of the rGAPDH counterscreen in 1536-well format

Anton Simeonov, Ajit Jadhav, Xin Hu, 2015 .

Predictive Models for Cytochrome P450 Isozymes Based on Quantitative High Throughput Screening Data

Ruili Huang, Menghang Xia, Christopher P. Austin, 2011, J. Chem. Inf. Model..

Exploring Polypharmacology Using a ROCS-Based Target Fishing Approach

Anders Wallqvist, Narender Singh, Mohamed Diwan M. AbdulHameed, 2012, J. Chem. Inf. Model..

SMILES-BERT: Large Scale Unsupervised Pre-Training for Molecular Property Prediction

Junzhou Huang, Sheng Wang, Yuhong Wang, 2019, BCB.

A Universal Molecular Descriptor System for Prediction of LogP, LogS, LogBB, and Absorption

Hongmao Sun, Hongmao Sun, 2004, J. Chem. Inf. Model..

Development of Quantitative Structure-Property Relationship Models for Early ADME Evaluation in Drug Discovery. 2. Blood-Brain Barrier Penetration

Ruifeng Liu, Hongmao Sun, Sung-Sau So, 2001, J. Chem. Inf. Comput. Sci..

Structure Based Model for the Prediction of Phospholipidosis Induction Potential of Small Molecules

Ruili Huang, Menghang Xia, Christopher P. Austin, 2012, J. Chem. Inf. Model..

Table 1, Stepwise protocol of the HPGD primary screen in 1536-well format

Anton Simeonov, Ajit Jadhav, Xin Hu, 2015 .

Protein contact map prediction using bi-directional recurrent neural network

Wei Li, Yuhong Wang, Kennie Cruz-Gutierrez, 2019, 1906.04527.

Prediction of Chemical Carcinogenicity from Molecular Structure

Hongmao Sun, Hongmao Sun, 2004, J. Chem. Inf. Model..

Enhancing Specificity and Sensitivity of Pharmacophore-Based Virtual Screening by Incorporating Chemical and Shape Features-A Case Study of HIV Protease Inhibitors

Hongmao Sun, Sung-Sau So, Deepangi Pandit, 2006, J. Chem. Inf. Model..

Automated Pharmacophore Query Optimization with Genetic AlgorithmsA Case Study Using the MC4R System

Lei Jia, Hongmao Sun, Sung-Sau So, 2007, J. Chem. Inf. Model..

A physicochemical descriptor-based scoring scheme for effective and rapid filtering of kinase-like chemical space

Anders Wallqvist, Narender Singh, Mohamed Diwan M. AbdulHameed, 2012, Journal of Cheminformatics.

Paradigm Shift in Toxicity Testing and Modeling

Ruili Huang, Menghang Xia, Christopher P. Austin, 2012, The AAPS Journal.

Development of Quantitative Structure—Property Relationship Models for Early ADME Evaluation in Drug Discovery. Part 2. Blood‐Brain Barrier Penetration.

Ruifeng Liu, Hongmao Sun, Sung-Sau So, 2002 .

Classification of scaffold-hopping approaches.

Anders Wallqvist, Hongmao Sun, Gregory Tawa, 2012, Drug discovery today.

Enhancing Specificity and Sensitivity of Pharmacophore‐Based Virtual Screening by Incorporating Chemical and Shape Features — A Case Study of HIV Protease Inhibitors.

Hongmao Sun, Sung-Sau So, Deepangi Pandit, 2006 .