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Dani Setiawan
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Strength of the pnicogen bond in complexes involving group Va elements N, P, and As
D Setiawan, E Kraka, D Cremer
The Journal of Physical Chemistry A 119 (9), 1642-1656, 2015
1512015
A first principles study of fluorescence quenching in rhodamine B dimers: how can quenching occur in dimeric species?
D Setiawan, A Kazaryan, MA Martoprawiro, M Filatov
Physical Chemistry Chemical Physics 12 (37), 11238-11244, 2010
1282010
Direct measure of metal–ligand bonding replacing the tolman electronic parameter
D Setiawan, R Kalescky, E Kraka, D Cremer
Inorganic chemistry 55 (5), 2332-2344, 2016
1092016
Re‐evaluation of the bond length–bond strength rule: The stronger bond is not always the shorter bond
E Kraka, D Setiawan, D Cremer
Journal of Computational Chemistry 37 (1), 130-142, 2016
962016
Description of pnicogen bonding with the help of vibrational spectroscopy—The missing link between theory and experiment
D Setiawan, E Kraka, D Cremer
Chemical Physics Letters 614, 136-142, 2014
772014
EvoDesign: designing protein–protein binding interactions using evolutionary interface profiles in conjunction with an optimized physical energy function
R Pearce, X Huang, D Setiawan, Y Zhang
Journal of molecular biology 431 (13), 2467-2476, 2019
692019
Quantitative assessment of aromaticity and antiaromaticity utilizing vibrational spectroscopy
D Setiawan, E Kraka, D Cremer
The Journal of Organic Chemistry 81 (20), 9669-9686, 2016
642016
Hidden bond anomalies: The peculiar case of the fluorinated amine chalcogenides
D Setiawan, E Kraka, D Cremer
The Journal of Physical Chemistry A 119 (36), 9541-9556, 2015
602015
Super-pnicogen bonding in the radical anion of the fluorophosphine dimer
D Setiawan, D Cremer
Chemical Physics Letters 662, 182-187, 2016
552016
From strong to weak NF bonds: on the design of a new class of fluorinating agents
D Setiawan, D Sethio, D Cremer, E Kraka
Physical Chemistry Chemical Physics 20 (37), 23913-23927, 2018
492018
Recent advances in automated protein design and its future challenges
D Setiawan, J Brender, Y Zhang
Expert opinion on drug discovery 13 (7), 587-604, 2018
282018
Donor acceptor fluorophores: synthesis, optical properties, TD-DFT and cytotoxicity studies
ZM Essam, GE Ozmen, D Setiawan, RR Hamid, RM Abd El-Aal, R Aneja, ...
Organic & biomolecular chemistry 19 (8), 1835-1846, 2021
212021
Computational benchmarking of putative KIFC1 inhibitors
N Sharma, D Setiawan, D Hamelberg, R Narayan, R Aneja
Medicinal Research Reviews 43 (2), 293-318, 2023
42023
Formation of bonded exciplex in the excited states of dicyanoanthracene-pyridine system: Time dependent density functional theory study
D Setiawan, D Sethio, MA Martoprawiro, M Filatov
Proceedings of the 2011 2nd International Congress on Computer Applications …, 2012
22012
Sintesis Kitosan-Rhodamine B yang Memiliki Potensi sebagai Material Padat Penghasil Dye Laser
D Setiawan
2007
Supporting information for: From Strong to Weak NF Bonds: On the Design of a New Class of Fluorinating Agents
D Setiawan, D Sethio, D Cremer, E Kraka
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