| Autonomy in materials research: a case study in carbon nanotube growth P Nikolaev, D Hooper, F Webber, R Rao, K Decker, M Krein, J Poleski, ... npj Computational Materials 2 (1), 1-6, 2016 | 304 | 2016 |
| In vitro prototyping and rapid optimization of biosynthetic enzymes for cell design AS Karim, QM Dudley, A Juminaga, Y Yuan, SA Crowe, JT Heggestad, ... Nature Chemical Biology 16 (8), 912-919, 2020 | 203 | 2020 |
| Stalking the materials genome: a data‐driven approach to the virtual design of nanostructured polymers CM Breneman, LC Brinson, LS Schadler, B Natarajan, M Krein, K Wu, ... Advanced functional materials 23 (46), 5746-5752, 2013 | 94 | 2013 |
| Binding affinity prediction with property-encoded shape distribution signatures S Das, MP Krein, CM Breneman Journal of chemical information and modeling 50 (2), 298-308, 2010 | 77 | 2010 |
| MQSPR modeling in materials informatics: a way to shorten design cycles? N Sukumar, M Krein, Q Luo, C Breneman Journal of Materials Science 47, 7703-7715, 2012 | 31 | 2012 |
| Exploration of the topology of chemical spaces with network measures MP Krein, N Sukumar The Journal of Physical Chemistry A 115 (45), 12905-12918, 2011 | 26 | 2011 |
| Bio-and Chem-Informatics: where do the twain meet N Sukumar, M Krein, CM Breneman Curr Opin Drug Discov Dev 11, 311-319, 2008 | 23 | 2008 |
| PESDserv: a server for high-throughput comparison of protein binding site surfaces S Das, MP Krein, CM Breneman Bioinformatics 26 (15), 1913-1914, 2010 | 20 | 2010 |
| Developing best practices for descriptor‐based property prediction: appropriate matching of datasets, descriptors, methods, and expectations M Krein, TW Huang, L Morkowchuk, DK Agrafiotis, CM Breneman Statistical Modelling of Molecular Descriptors in QSAR/QSPR 2, 33-64, 2012 | 17 | 2012 |
| From drug discovery QSAR to predictive materials QSPR: the evolution of descriptors, methods, and models K Wu, B Natarajan, L Morkowchuk, M Krein, CM Breneman Informatics for materials science and engineering, 385-422, 2013 | 15 | 2013 |
| A quantitative structure–activity relationship to predict efficacy of granular activated carbon adsorption to control emerging contaminants AR Kennicutt, L Morkowchuk, M Krein, CM Breneman, JE Kilduff SAR and QSAR in Environmental Research 27 (8), 653-676, 2016 | 12 | 2016 |
| Autonomy in materials research: a case study in carbon nanotube growth. npj Computational Materials 2 P Nikolaev, D Hooper, F Webber, R Rao, K Decker, M Krein, J Poleski, ... | 12 | 2016 |
| Autonomous experimentation applied to carbon nanotube synthesis B Maruyama, K Decker, M Krein, J Poleski, R Barto, F Webber, P Nikolaev Microscopy and Microanalysis 23 (S1), 182-182, 2017 | 10 | 2017 |
| Sensing and assessing cognitive workload across multiple tasks MD Ziegler, A Kraft, M Krein, LC Lo, B Hatfield, W Casebeer, B Russell Foundations of Augmented Cognition: Neuroergonomics and Operational …, 2016 | 10 | 2016 |
| Development of materials informatics tools and infrastructure to enable high throughput materials design MP Krein, B Natarajan, LS Schadler, LC Brinson, H Deng, D Gai, Y Li, ... MRS Online Proceedings Library (OPL) 1425, mrsf11-1425-uu06-05, 2012 | 10 | 2012 |
| Prediction of peptide bonding affinity: kernel methods for nonlinear modeling C Bergeron, T Hepburn, CM Sundling, M Krein, B Katt, N Sukumar, ... arXiv preprint arXiv:1108.5397, 2011 | 10 | 2011 |
| On the development and use of large chemical similarity networks, informatics best practices and novel chemical descriptors towards materials quantitative structure property … M Krein Rensselaer Polytechnic Institute, 2011 | 10 | 2011 |
| A systematic approach to developing near real-time performance predictions based on physiological measures AE Kraft, J Russo, M Krein, B Russell, W Casebeer, M Ziegler 2017 IEEE Conference on Cognitive and Computational Aspects of Situation …, 2017 | 9 | 2017 |
| Autonomy in materials research: a case study in carbon nanotube growth. Npj Comput Mater 2: 16031 P Nikolaev, D Hooper, F Webber, R Rao, K Decker, M Krein, J Poleski, ... | 9 | 2016 |
| Graphs and networks in chemical and biological informatics: past, present and future N Sukumar, MP Krein Future medicinal chemistry 4 (16), 2039-2047, 2012 | 9 | 2012 |
Curt BrenemanDean of Science, Professor of Chemistry & Chemical Biology, Rensselaer Polytechnic InstituteVerified email at rpi.edu