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Zero Shot Molecular Generation via Similarity Kernels
by
Rokas Elijošius
,
Zills, Fabian
,
Ilyes Batatia
,
Sam Walton Norwood
,
Dávid Péter Kovács
,
Holm, Christian
,
Csányi, Gábor
Published in
arXiv.org
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A foundation model for atomistic materials chemistry
by
Ilyes Batatia
,
Benner, Philipp
,
Chiang, Yuan
,
Elena, Alin M
,
Kovács, Dávid P
,
Riebesell, Janosh
,
Advincula, Xavier R
,
Asta, Mark
,
Avaylon, Matthew
,
Baldwin, William J
,
Berger, Fabian
,
Bernstein, Noam
,
Bhowmik, Arghya
,
Blau, Samuel M
,
Cărare, Vlad
,
Darby, James P
,
De, Sandip
,
Flaviano Della Pia
,
Deringer, Volker L
,
Rokas Elijošius
,
El-Machachi, Zakariya
,
Falcioni, Fabio
,
Fako, Edvin
,
Ferrari, Andrea C
,
Genreith-Schriever, Annalena
,
George, Janine
,
Goodall, Rhys E A
,
Grey, Clare P
,
Grigorev, Petr
,
Han, Shuang
,
Handley, Will
,
Heenen, Hendrik H
,
Hermansson, Kersti
,
Holm, Christian
,
Jaafar, Jad
,
Hofmann, Stephan
,
Jakob, Konstantin S
,
Jung, Hyunwook
,
Kapil, Venkat
,
Kaplan, Aaron D
,
Karimitari, Nima
,
Kermode, James R
,
Kroupa, Namu
,
Kullgren, Jolla
,
Kuner, Matthew C
,
Kuryla, Domantas
,
Liepuoniute, Guoda
,
Margraf, Johannes T
,
Ioan-Bogdan Magdău
,
Michaelides, Angelos
,
Moore, J Harry
,
Naik, Aakash A
,
Niblett, Samuel P
,
Sam Walton Norwood
,
O'Neill, Niamh
,
Ortner, Christoph
,
Persson, Kristin A
,
Reuter, Karsten
,
Rosen, Andrew S
,
Schaaf, Lars L
,
Schran, Christoph
,
Shi, Benjamin X
,
Sivonxay, Eric
,
Stenczel, Tamás K
,
Svahn, Viktor
,
Sutton, Christopher
,
Swinburne, Thomas D
,
Tilly, Jules
,
Cas van der Oord
,
Varga-Umbrich, Eszter
,
Vegge, Tejs
,
Vondrák, Martin
,
Wang, Yangshuai
,
Witt, William C
,
Zills, Fabian
,
Csányi, Gábor
Published in
arXiv.org
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