A density functional tight binding layer for deep learning of chemical Hamiltonians H Li, C Collins, M Tanha, GJ Gordon, DJ Yaron Journal of chemical theory and computation 14 (11), 5764-5776, 2018 | 117 | 2018 |
Green polymer chemistry: lipase-catalyzed synthesis of bio-based reactive polyesters employing itaconic anhydride as a renewable monomer S Yamaguchi, M Tanha, A Hult, T Okuda, H Ohara, S Kobayashi Polymer journal 46 (1), 2-13, 2014 | 57 | 2014 |
Spectral fine tuning of cyanine dyes: electron donor–acceptor substituted analogues of thiazole orange EE Rastede, M Tanha, D Yaron, SC Watkins, AS Waggoner, BA Armitage Photochemical & Photobiological Sciences 14 (9), 1703-1712, 2015 | 31 | 2015 |
Computational and experimental characterization of a fluorescent dye for detection of potassium ion concentration M Tanha, SK Chakraborty, B Gabris, AS Waggoner, G Salama, D Yaron The Journal of Physical Chemistry A 118 (42), 9837-9843, 2014 | 11 | 2014 |
vol. 14, issue 11 H Li, C Collins, M Tanha, GJ Gordon, DJ Yaron J. Chem. Theory Comput, 5764, 2018 | 5 | 2018 |
Embedding parameters in ab initio theory to develop approximations based on molecular similarity M Tanha, H Li, S Kaul, A Cappiello, GJ Gordon, DJ Yaron arXiv preprint arXiv:1503.07852, 2015 | 1 | 2015 |
Embedding parameters in ab initio theory to develop well-controlled approximations based on molecular similarity M Tanha, S Kaul, A Cappiello, GJ Gordon, DJ Yaron arXiv preprint arXiv:1311.3440, 2013 | 1 | 2013 |
Development and Application of Efficient Data Analytic Methods in Quantum Chemistry M Tanha Carnegie Mellon University, 2015 | | 2015 |
New approaches to the development of semiempirical quantum chemical methods M Tanha, H Li, S Kaul, A Cappiello, E Gottlieb, GJ Gordon, DJ Yaron ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 248, 2014 | | 2014 |
Using molecular similarity to reduce the cost of electronic structure calculations M Tanha, S Kaul, GJ Gordon, D Yaron ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, 2012 | | 2012 |
Embedding empirical parameters in ab initio models to reduce the cost of electronic structure calculations DJ Yaron, M Tanha, S Kaul, GJ Gordon ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, 2012 | | 2012 |