Adil Kabylda

Accurate global machine learning force fields for molecules with hundreds of atoms

Stefan Chmiela, Valentín Vassilev-Galindo, Oliver T. Unke et al. · Science Advances · 2023 · 171 citations · Full text

Natural Sciences, Chemistry, Physics +17

Molecular Simulations with a Pretrained Neural Network and Universal Pairwise Force Fields

Adil Kabylda, J. Thorben Frank, Sergio Suarez Dou et al. · Journal of the American Chemical Society · 2025 · 49 citations · Full text

Natural Sciences, Biophysics, Chemistry +17

Efficient interatomic descriptors for accurate machine learning force fields of extended molecules

Adil Kabylda, Valentín Vassilev-Galindo, Stefan Chmiela et al. · Nature Communications · 2023 · 39 citations · Full text

Natural Sciences, Materials Science, Biomolecular Modeling +16

Bisguanidinium-Catalyzed Epoxidation of Allylic and Homoallylic Amines under Phase Transfer Conditions

Kek Foo Chin, Xinyi Ye, Yongxin Li et al. · ACS Catalysis · 2020 · 27 citations

Natural Sciences, Chemistry, Catalysis +9

Light Driven Ultrafast Bioinspired Molecular Motors: Steering and Accelerating Photoisomerization Dynamics of Retinal

Elisabeth Gruber, Adil Kabylda, Mogens Brøndsted Nielsen et al. · Journal of the American Chemical Society · 2021 · 21 citations

Natural Sciences, Biophysics, Physics +17