Showing results (21-30 of 105) with videos related to

Sort By:
Pageof 11
Drug Discovery Today|May 27, 2019
Voltage-gated sodium channels: structures, functions, and molecular modelingLei Xu, Xiaoqin Ding, Tianhu Wang, et al.
Physical Chemistry Chemical Physics : PCCP|April 5, 2017
Prediction of luciferase inhibitors by the high-performance MIEC-GBDT approach based on interaction energetic patternsFu Chen, Huiyong Sun, Hui Liu, et al.
Journal of Chemical Information and Modeling|July 28, 2017
Characterizing Drug-Target Residence Time with Metadynamics: How To Achieve Dissociation Rate Efficiently without Losing Accuracy against Time-Consuming ApproachesHuiyong Sun, Youyong Li, Mingyun Shen, et al.
ACS Applied Materials & Interfaces|September 2, 2017
Aggregated Single-Walled Carbon Nanotubes Absorb and Deform Dopamine-Related Proteins Based on Molecular Dynamics SimulationsYi Yu, Huiyong Sun, Keith Gilmore, et al.
Molecular Pharmaceutics|July 6, 2016
ADMET Evaluation in Drug Discovery. 16. Predicting hERG Blockers by Combining Multiple Pharmacophores and Machine Learning ApproachesShuangquan Wang, Huiyong Sun, Hui Liu, et al.
Journal of Cheminformatics|August 20, 2022
Predicting the mutation effects of protein-ligand interactions via end-point binding free energy calculations: strategies and analysesYang Yu, Zhe Wang, Lingling Wang, et al.
Briefings in Bioinformatics|December 29, 2022
Cooperation of structural motifs controls drug selectivity in cyclin-dependent kinases: an advanced theoretical analysisLingling Wang, Lei Xu, Zhe Wang, et al.
Molecular Pharmaceutics|February 7, 2014
ADMET evaluation in drug discovery. 13. Development of in silico prediction models for P-glycoprotein substratesDan Li, Lei Chen, Youyong Li, et al.
Bioinformatics (Oxford, England)|June 12, 2020
Fast and accurate prediction of partial charges using Atom-Path-Descriptor-based machine learningJike Wang, Dongsheng Cao, Cunchen Tang, et al.
Macromolecular Bioscience|October 15, 2025
A Composite Sponge Based on Carboxymethyl Chitosan- Panax Notoginseng Polysaccharides for Rapid Hemostasis and Wound HealingMei Zhang, Huiyong Sun, Tianci Liu, et al.
Pageof 11