About the Authors

Lei Chen

Contributed equally to this work with: Lei Chen, Jing Lu

Affiliation College of Information Engineering, Shanghai Maritime University, Shanghai, China

Jing Lu

Contributed equally to this work with: Lei Chen, Jing Lu

Affiliation Drug Discovery and Design Center (DDDC), Shanghai Institute of Materia Medica, Shanghai, China

Jian Zhang

Affiliation Department of Ophthalmology, Shanghai First People’s Hospital Affiliated to Shanghai Jiaotong University, Shanghai, China

Kai-Rui Feng

Affiliation Simcyp Limited, Blades Enterprise Centre, Sheffield, United Kingdom

Ming-Yue Zheng

myzheng@mail.shcnc.ac.cn (MYZ); cai_yud@yahoo.com.cn (YDC)

Affiliation Drug Discovery and Design Center (DDDC), Shanghai Institute of Materia Medica, Shanghai, China

Yu-Dong Cai

myzheng@mail.shcnc.ac.cn (MYZ); cai_yud@yahoo.com.cn (YDC)

Affiliation Institute of Systems Biology, Shanghai University, Shanghai, China

Competing Interests

One co-author, Dr. Kai-Rui Feng is employed by a commercial company, Simcyp Limited, but he contributed to the study in his spare time. This project doesn’t receive any grants or financial support from Simcyp Limited. Also, Simcyp Limited has no influence on any aspects of this research. This does not alter the authors’ adherence to all the PLOS ONE policies on sharing data and materials.

Author Contributions

Conceived and designed the experiments: LC JZ MYZ YDC. Performed the experiments: LC JL KRF. Analyzed the data: JL JZ MYZ. Contributed reagents/materials/analysis tools: LC JL KRF MYZ YDC. Wrote the paper: LC JL KRF.