Quantification of secondary electrostatic interactions in H-bonded complexes.
Physical Chemistry Chemical Physics
(2022)
24
18124
(doi: 10.1039/d2cp03004g)
Systematic Parameterization of Ion-Surfactant Interactions in Dissipative Particle Dynamics Using Setschenow Coefficients
The journal of physical chemistry. B
(2022)
126
2308
(doi: 10.1021/acs.jpcb.2c00101)
ThX: a next generation probe for the early detection of amyloid aggregates
Biophysical Journal
(2022)
121
19a
(doi: 10.1016/j.bpj.2021.11.2608)
Combined computational/experimental investigation of new cocrystals of the drug bosentan
CrystEngComm
(2022)
24
5105
(doi: 10.1039/d2ce00581f)
SSIPTools: Software and Methodology for Surface Site Interaction Point (SSIP) Approach and Applications
Journal of Chemical Information and Modeling
(2021)
61
5331
(doi: 10.1021/acs.jcim.1c01006)
Duplex vs. folding: tuning the self-assembly of synthetic recognition-encoded aniline oligomers.
Organic & Biomolecular Chemistry
(2021)
19
8947
(doi: 10.1039/d1ob01882e)
Artificial transmembrane signal transduction mediated by dynamic covalent chemistry
Chemical science
(2021)
12
14059
(doi: 10.1039/d1sc04741h)
Dissection of the Polar and Non-Polar Contributions to Aromatic Stacking Interactions in Solution
Angewandte Chemie International Edition
(2021)
60
23871
(doi: 10.1002/anie.202110809)
Dissection of the Polar and Non‐Polar Contributions to Aromatic Stacking Interactions in Solution
Angewandte Chemie
(2021)
133
24064
(doi: 10.1002/ange.202110809)
An empirical model for solvation based on surface site interaction points.
Chem Sci
(2021)
12
13193
(doi: 10.1039/d1sc03392a)
Transmembrane signal transduction by cofactor transport
Chemical science
(2021)
12
12377
(doi: 10.1039/d1sc03910e)
High-affinity tamoxifen analogues retain extensive positional disorder when bound to calmodulin
Magnetic Resonance
(2021)
2
629
(doi: 10.5194/mr-2-629-2021)
Folding and duplex formation in mixed sequence recognition-encoded m-phenylene ethynylene polymers.
Chemical Science
(2021)
12
10218
(doi: 10.1039/d1sc02288a)
Mapping the Binding Site Topology of Amyloid Protein Aggregates using Multivalent Ligands.
Chem Sci
(2021)
12
8892
(doi: 10.1039/d1sc01263k)
High-Fidelity Sequence-Selective Duplex Formation by Recognition-Encoded Melamine Oligomers
Journal of the American Chemical Society
(2021)
143
8669
(doi: 10.1021/jacs.1c02275)
Translation of Chemical Structure into Dissipative Particle Dynamics Parameters For Simulation of Surfactant Self-Assembly.
The Journal of Physical Chemistry B
(2021)
125
3942
(doi: 10.1021/acs.jpcb.1c00480)
Replication of Sequence Information in Synthetic Oligomers.
Accounts of Chemical Research
(2021)
54
1298
(doi: 10.1021/acs.accounts.0c00852)
Controlled mutation in the replication of synthetic oligomers
Chemical science
(2021)
12
4063
(doi: 10.1039/d0sc06770a)
Stimuli-Responsive Self-Sorting Hybrid Hydrogen-Bonded/Metal-Coordinated Cage
Chemistry – A European Journal
(2021)
27
3302
(doi: 10.1002/chem.202005283)
