| Overcoming catastrophic forgetting in neural networks J Kirkpatrick, R Pascanu, N Rabinowitz, J Veness, G Desjardins, AA Rusu, ... Proceedings of the national academy of sciences 114 (13), 3521-3526, 2017 | 8613 | 2017 |
| Improved protein structure prediction using potentials from deep learning AW Senior, R Evans, J Jumper, J Kirkpatrick, L Sifre, T Green, C Qin, ... Nature 577 (7792), 706-710, 2020 | 3550 | 2020 |
| Progressive neural networks AA Rusu, NC Rabinowitz, G Desjardins, H Soyer, J Kirkpatrick, ... arXiv preprint arXiv:1606.04671, 2016 | 3236 | 2016 |
| Policy distillation AA Rusu, SG Colmenarejo, C Gulcehre, G Desjardins, J Kirkpatrick, ... arXiv preprint arXiv:1511.06295, 2015 | 864 | 2015 |
| Indacenodithiophene semiconducting polymers for high-performance, air-stable transistors W Zhang, J Smith, SE Watkins, R Gysel, M McGehee, A Salleo, ... Journal of the American Chemical Society 132 (33), 11437-11439, 2010 | 687 | 2010 |
| Distral: Robust multitask reinforcement learning Y Teh, V Bapst, WM Czarnecki, J Quan, J Kirkpatrick, R Hadsell, N Heess, ... Advances in neural information processing systems 30, 2017 | 643 | 2017 |
| Towards high charge-carrier mobilities by rational design of the shape and periphery of discotics X Feng, V Marcon, W Pisula, MR Hansen, J Kirkpatrick, F Grozema, ... Nature materials 8 (5), 421-426, 2009 | 607 | 2009 |
| Recombination via tail states in polythiophene: fullerene solar cells T Kirchartz, BE Pieters, J Kirkpatrick, U Rau, J Nelson Physical Review B—Condensed Matter and Materials Physics 83 (11), 115209, 2011 | 489 | 2011 |
| Microscopic simulations of charge transport in disordered organic semiconductors V Rühle, A Lukyanov, F May, M Schrader, T Vehoff, J Kirkpatrick, ... Journal of chemical theory and computation 7 (10), 3335-3345, 2011 | 458 | 2011 |
| Protein structure prediction using multiple deep neural networks in the 13th Critical Assessment of Protein Structure Prediction (CASP13) AW Senior, R Evans, J Jumper, J Kirkpatrick, L Sifre, T Green, C Qin, ... Proteins: structure, function, and bioinformatics 87 (12), 1141-1148, 2019 | 356 | 2019 |
| Pushing the frontiers of density functionals by solving the fractional electron problem J Kirkpatrick, B McMorrow, DHP Turban, AL Gaunt, JS Spencer, ... Science 374 (6573), 1385-1389, 2021 | 345 | 2021 |
| Modeling charge transport in organic photovoltaic materials J Nelson, JJ Kwiatkowski, J Kirkpatrick, JM Frost Accounts of chemical research 42 (11), 1768-1778, 2009 | 329 | 2009 |
| Density-functional based determination of intermolecular charge transfer properties for large-scale morphologies B Baumeier, J Kirkpatrick, D Andrienko Physical Chemistry Chemical Physics 12 (36), 11103-11113, 2010 | 297 | 2010 |
| Factors limiting the efficiency of molecular photovoltaic devices J Nelson, J Kirkpatrick, P Ravirajan Physical Review B 69 (3), 035337, 2004 | 252 | 2004 |
| Systematic improvement in charge carrier mobility of air stable triarylamine copolymers W Zhang, J Smith, R Hamilton, M Heeney, J Kirkpatrick, K Song, ... Journal of the American Chemical Society 131 (31), 10814-10815, 2009 | 236 | 2009 |
| An approximate method for calculating transfer integrals based on the ZINDO Hamiltonian J Kirkpatrick International Journal of Quantum Chemistry 108 (1), 51-56, 2008 | 225 | 2008 |
| Charge mobility of discotic mesophases: A multiscale quantum and classical study J Kirkpatrick, V Marcon, J Nelson, K Kremer, D Andrienko Physical review letters 98 (22), 227402, 2007 | 225 | 2007 |
| De novo structure prediction with deeplearning based scoring R Evans, J Jumper, J Kirkpatrick, L Sifre, T Green, C Qin, A Zidek, ... Annu Rev Biochem 77 (363-382), 6, 2018 | 157 | 2018 |
| Simple gnn regularisation for 3d molecular property prediction & beyond J Godwin, M Schaarschmidt, A Gaunt, A Sanchez-Gonzalez, Y Rubanova, ... arXiv preprint arXiv:2106.07971, 2021 | 127 | 2021 |
| Influence of polar medium on the reorganization energy of charge transfer between dyes in a dye sensitized film V Vaissier, P Barnes, J Kirkpatrick, J Nelson Physical Chemistry Chemical Physics 15 (13), 4804-4814, 2013 | 121 | 2013 |
Denis AndrienkoMax Planck Institute for Polymer ResearchEmail verificata su mpip-mainz.mpg.de
