Journal of the American Chemical Society

Enhanced Binding Site Identification in Protein–Ligand Complexes with a Combined Blind Docking and Dipolar Electron Paramagnetic Resonance Approach

M Mikhail Kolokolov (EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia) N Natalya Sannikova (EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia) S Sergei Dementev (EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia) R Roman Podarov (EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia) K Kseniya Zhdanova (Institute of Fine Chemical Technology, MIREA−Russian Technological University, 78 Vernadsky Avenue, Moscow 119454, Russia) N Natal’ya Bragina (Institute of Fine Chemical Technology, MIREA−Russian Technological University, 78 Vernadsky Avenue, Moscow 119454, Russia) A Alexey Chubarov (Department of Physics, Free University of Berlin, Arnimallee 14, Berlin 14195, Germany) M Matvey Fedin (EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia) O Olesya Krumkacheva (EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia)
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Article Details

Volume / Issue Vol. 147, Issue 16
Published April 23, 2025
Pages 13677-13687
ISSN 0002-7863
Publisher American Chemical Society

Journal Info

Journal of the American Chemical Society

American Chemical Society
ISSN: 0002-7863 Physical Sciences

Authors (9)

M

Mikhail Kolokolov

EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia

N

Natalya Sannikova

EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia

S

Sergei Dementev

EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia

R

Roman Podarov

EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia

K

Kseniya Zhdanova

Institute of Fine Chemical Technology, MIREA−Russian Technological University, 78 Vernadsky Avenue, Moscow 119454, Russia

N

Natal’ya Bragina

Institute of Fine Chemical Technology, MIREA−Russian Technological University, 78 Vernadsky Avenue, Moscow 119454, Russia

A

Alexey Chubarov

Department of Physics, Free University of Berlin, Arnimallee 14, Berlin 14195, Germany

M

Matvey Fedin

EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia

O

Olesya Krumkacheva

EPR Laboratory, International Tomography Center SB RAS, 3 Institutskaya Street, Novosibirsk 630090, Russia

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