Search

Categories

Biological and Medicinal Chemistry

(2)

Organic Chemistry

(1)

Theoretical and Computational Chemistry

(3)

Content Types

Review

(1)

Working Paper

(2)

Published Date

Over 3 years

(1)

Last 3 years

(2)

Keywords

Authors

Marwin Segler

3 results in Authors: Marwin Segler

Theoretical and Computational Chemistry

Learning chemical intuition from humans in the loop

Oh-Hyeon Choung, Riccardo Vianello, Marwin Segler, Nikolaus Stiefl, José Jiménez-Luna

Version 2 posted 16 March 2023

3,826

Downloads

Theoretical and Computational Chemistry

Fake it until you make it? Generative De Novo Design and Virtual Screening of Synthesizable Molecules

Megan Stanley, Marwin Segler

Version 2 posted 12 July 2023

1,271

Downloads

Theoretical and Computational Chemistry

Proteochemometric Models Using Multiple Sequence Alignments and a Subword Segmented Masked Language Model

Héléna Alexandra Gaspar, Mohamed Ahmed, Thomas Edlich, Benedek Fabian, Zsolt Varszegi, Marwin Segler, Joshua Meyers, Marco Fiscato

Version 1 posted 20 May 2021

766

Downloads

1

Citations