Journal of Cheminformatics

作者Souvik Dey; Pinyi Lu; Anders Wallqvist; Mohamed Diwan M. AbdulHameed

作者单位1. Department of Defense Biotechnology High Performance Computing Software Applications Institute, Defense Health Agency Research & Development, Medical Research and Development Command, Fort Detrick, USA; 2. The Henry M. Jackson Foundation for the Advancement of Military Medicine, Inc., Bethesda, USA

作者Xiaobo Lin; Logan T. Kearney; Zhaoqian Su; Yunchao Liu; Amit K. Naskar; Debsindhu Bhowmik

作者单位1. Carbon and Composites Group, Chemical Sciences Division, Oak Ridge National Laboratory, Oak Ridge, USA; 2. Research, Takeda Pharmaceutical Company Ltd., Cambridge, USA; 3. Broad Institute of MIT and Harvard, Cambridge, USA; 4. Computational Sciences and Engineering Division, Oak Ridge National Laboratory, Oak Ridge, USA

作者Ju Hyung Lee; Seongik Choi; Utku Ozbulak; Joris Vankerschaver; Wesley De Neve

作者单位1. Center for Biosystems and Biotech Data Science, Ghent University Global Campus, Incheon, South Korea; 2. Department of Electronics and Information Systems, Ghent University, Ghent, Belgium; 3. Computational Data Sciences Department, George Mason University Korea, Incheon, South Korea; 4. Department of Applied Mathematics, Computer Science and Statistics, Ghent University, Ghent, Belgium

作者Nicola Gambacorta; Daniela Trisciuzzi; Fabrizio Mastrolorito; Francesco Leonetti; Cosimo D. Altomare; Modesto de Candia; Marco Catto; Nicola Amoroso; Fulvio Ciriaco; Orazio Nicolotti

作者单位1. Department of Biosciences, Biotechnology and Environment, University of Bari Aldo Moro, Bari, Italy; 2. Department of Pharmacy-Pharmaceutical Sciences, University of Bari Aldo Moro, Bari, Italy; 3. Department of Chemistry, University of Bari Aldo Moro, Bari, Italy

作者Veincent Yap; Pan Xu; Frankie S. Mak; Klement Foo; Congbao Kang; Padmanabhan Anbazhagan; Weijun Xu

作者单位1. Experimental Drug Development Centre, Agency for Science, Technology and Research (A*STAR), Singapore, Singapore

作者Jing Liu; Li Xue; Yin Wang; Qiaorong Wu; Wenwei Tao; Yiwei Wang; Jianming Wu; Jiesi Luo

作者单位1. Institute of Cardiovascular Medicine Research, Southwest Medical University, Luzhou, China; 2. School of Public Health, Southwest Medical University, Luzhou, China; 3. Basic Medical Science, Southwest Medical University, Luzhou, China

作者Methun Kamruzzaman; Alexander Landera; Nalini Menon; Mark D. Allendorf; Kunal Poorey

作者单位1. (Former) Applied Biosciences and Engineering, Sandia National Laboratories, Livermore, USA; 2. Department of Computer Science and Data Science, Meharry Medical College, Nashville, USA; 3. Applied Biosciences and Engineering, Sandia National Laboratories, Livermore, USA; 4. Material Characterization and Performance, Sandia National Laboratories, Livermore, USA; 5. (Former) Materials Research, Sandia National Laboratories, Livermore, USA; 6. Honorary Sr. Visiting Scholar, Washington University in St. Louis, St. Louis, USA; 7. Material Lifecycle management, Sandia National Laboratories, Livermore, USA

作者Daniel Miliate; Ashlie Martini

作者单位1. Department of Mechanical and Aerospace Engineering, University of California Merced, Merced, USA

作者Konrad Krämer; Pierre Tremouilhac; Fabian Mauz; Christoph Grathwol; Nicole Jung; Stefan Bräse

作者单位1. Institute of Biological and Chemical Systems, Functional Molecular Systems (IBCS), Karlsruhe Institute of Technology, Karlsruhe, Germany; 2. Department of Bioorganic Chemistry, Leibniz Institute of Plant Biochemistry (IPB), Halle (Saale), Germany; 3. Karlsruhe Nano Micro Facility (KNMFi), Karlsruhe Institute of Technology, Karlsruhe, Germany; 4. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Karlsruhe, Germany

作者Yingjuan Cheng; Qing Ye; Linlong Jiang; Yu Kang; Chang-Yu Hsieh; Tingjun Hou

作者单位1. College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, China; 2. Zhejiang Provincial Key Laboratory for Intelligent Drug Discovery and Development, Jinhua, China