Xiaohua Zhang

Xiaohua Zhang

Lawrence Livermore National Laboratory - Livermore / United States
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 4384642
person_outline Xiaohua Zhang's MOST POPULAR ARTICLES
1-) Urea-Functionalized M4L6 Cage Receptors: Anion-Templated Self-Assembly and Selective Guest Exchange in Aqueous SolutionsR Custelcean, PV Bonnesen, NC Duncan, X Zhang, LA Watson, ...Journal of the American Chemical Society 134 (20), 8525-8534, 20121982012
2-) Improved protein–ligand binding affinity prediction with structure-based deep fusion inferenceD Jones, H Kim, X Zhang, A Zemla, G Stevenson, WFD Bennett, ...Journal of chemical information and modeling 61 (4), 1583-1592, 20211202021
3-) A comprehensive docking and MM/GBSA rescoring study of ligand recognition upon binding antithrombinX Zhang, H Perez-Sanchez, F C LightstoneCurrent topics in medicinal chemistry 17 (14), 1631-1639, 20171192017
4-) Toward fully automated high performance computing drug discovery: a massively parallel virtual screening pipeline for docking and molecular mechanics/generalized Born surface …X Zhang, SE Wong, FC LightstoneJournal of chemical information and modeling 54 (1), 324-337, 2014992014
5-) Message passing interface and multithreading hybrid for parallel molecular docking of large databases on petascale high performance computing machinesX Zhang, SE Wong, FC LightstoneJournal of computational chemistry 34 (11), 915-927, 2013972013