1. Computational prediction of Lee retention indices of polycyclic aromatic hydrocarbons by using machine learning. (30th September 2022) Authors: Sun, Linkang; Zhang, Min; Xie, Liangxu; Xu, Xiaojun; Xu, Peng; Xu, Lei Journal: Chemical biology & drug design Issue: Volume 101:Number 2(2023) Page Start: 380 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Counterion distribution around a polyelectrolyte confined in a metal–organic framework. Issue 10 (3rd July 2022) Authors: Xie, Liangxu; Chan, Kwong-Yu; Li, Vanessa Chi-Ying Journal: Molecular simulation Issue: Volume 48:Issue 10(2022) Page Start: 926 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Cover Image. (15th October 2020) Authors: Xie, Liangxu; Xu, Lei; Chang, Shan; Xu, Xiaojun; Meng, Li Journal: Chemical biology & drug design Issue: Volume 96:Number 3(2020) Page Start: i Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Enhanced molecular dynamics simulation of the transformation between α-helix and β-hairpin structures for peptide. (1st September 2016) Authors: Xie, Liangxu; Chen, Zhe-Ning Journal: Molecular physics Issue: Volume 114:Number 16/17(2016) Page Start: 2424 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Facet engineered TiO2 hollow sphere for the visible-light-mediated degradation of antibiotics via ligand-to-metal charge transfer. Issue 7 (May 2020) Authors: Zhang, Sai; Yin, Zhengliang; Xie, Liangxu; Yi, Jianjian; Tang, Wenjie; Tang, Tao; Chen, Jinyu; Cao, Shunsheng Journal: Ceramics international Issue: Volume 46:Issue 7(2020) Page Start: 8949 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. In silico prediction of boiling point, octanol–water partition coefficient, and retention time index of polycyclic aromatic hydrocarbons through machine learning. (28th July 2022) Authors: Sun, Linkang; Zhang, Min; Xie, Liangxu; Gao, Qian; Xu, Xiaojun; Xu, Lei Journal: Chemical biology & drug design Issue: Volume 101:Number 1(2023) Page Start: 52 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Mechanistic Insights and Rational Design of a Versatile Surface with Cells/Bacteria Recognition Capability via Orientated Fusion Peptides. Issue 9 (4th March 2019) Authors: Wang, Lin; Chen, Junjian; Zeng, Xiangze; Cheung, Peter Pak‐Hang; Zheng, Xiaoyan; Xie, Liangxu; Shi, Xuetao; Ren, Li; Huang, Xuhui; Wang, Yingjun Journal: Advanced science Issue: Volume 6:Issue 9(2019) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Multi-responsive, bidirectional, and large deformation bending actuators based on borax cross-linked polyvinyl alcohol derivative hydrogel. Issue 63 (16th August 2017) Authors: Gao, Liang; Guo, Guoqiang; Liu, Mengjuan; Tang, Zeguo; Xie, Liangxu; Huo, Yanping Journal: RSC advances Issue: Volume 7:Issue 63(2017) Page Start: 40005 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Multitask deep networks with grid featurization achieve improved scoring performance for protein–ligand binding. (15th October 2020) Authors: Xie, Liangxu; Xu, Lei; Chang, Shan; Xu, Xiaojun; Meng, Li Journal: Chemical biology & drug design Issue: Volume 96:Number 3(2020) Page Start: 973 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Thermodynamic properties of solvated peptides from selective integrated tempering sampling with a new weighting factor estimation algorithm. (3rd April 2017) Authors: Shen, Lin; Xie, Liangxu; Yang, Mingjun Journal: Molecular physics Issue: Volume 115:Number 7(2017) Page Start: 885 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗