[PDF][PDF] Towards understanding π-stacking interactions between non-aromatic rings

K Molčanov, B Kojić-Prodić - IUCrJ, 2019 - journals.iucr.org
The first systematic study of π interactions between non-aromatic rings, based on the
authors' own results from an experimental X-ray charge-density analysis assisted by …

Open questions in organic crystal polymorphism

AJ Cruz-Cabeza, N Feeder, RJ Davey - Communications Chemistry, 2020 - nature.com
Polymorphs, crystals with different structure and properties but the same molecular
composition, arise from the subtle interplay between thermodynamics and kinetics during …

Molecular mechanism of crystal nucleation from solution

X Li, J Wang, T Wang, N Wang, S Zong, X Huang… - Science China …, 2021 - Springer
Nucleation from solution is fundamental to many natural and industrial processes. The
understanding of molecular mechanism of nucleation from solution is conducive to predict …

A review of experimental methods for nucleation rate determination in large-volume batch and microfluidic crystallization

C Devos, T Van Gerven, S Kuhn - Crystal growth & design, 2021 - ACS Publications
Determination of the experimental nucleation rate for crystallization in solution has been
acknowledged as an important topic for a long time, as it improves the design and control of …

Comparative Study on the Preparation and Gas Sensing Properties of Reduced Graphene Oxide/SnO2 Binary Nanocomposite for Detection of Acetone in Exhaled …

R Kalidoss, S Umapathy, R Anandan… - Analytical …, 2019 - ACS Publications
Reduced graphene oxide/tin dioxide (RGO/SnO2) binary nanocomposite for acetone
sensing performance was successfully studied and applied in exhaled breath detection. The …

Concerning elusive crystal forms: The case of paracetamol

Y Liu, B Gabriele, RJ Davey… - Journal of the American …, 2020 - ACS Publications
Increasing commercial application of state of the art crystal structure prediction to aid solid
form discovery of new molecular entities allows the experimentalist to target the polymorphs …

The unexpected discovery of the ninth polymorph of tolfenamic acid

P Sacchi, SM Reutzel-Edens, AJ Cruz-Cabeza - CrystEngComm, 2021 - pubs.rsc.org
Tolfenamic acid (TFA) is a very well-studied polymorphic compound with eight polymorphs
discovered to date. Here, we report on a new polymorph of TFA, form IX, which was …

Transforming computed energy landscapes into experimental realities: the role of structural rugosity

R Montis, RJ Davey, SE Wright… - Angewandte …, 2020 - Wiley Online Library
We exploit the possible link between structural surface roughness and difficulty of
crystallisation. Polymorphs with smooth surfaces may nucleate and crystallise more readily …

Quantifying the inherent uncertainty associated with nucleation rates estimated from induction time data measured in small volumes

Y Xiao, SK Tang, H Hao, RJ Davey… - Crystal Growth & …, 2017 - ACS Publications
Unravelling the molecular complexities of crystal nucleation from solutions is predicated on
our ability to measure and interpret high quality kinetic data. This allows us to link nucleation …

Understanding and Designing Tailor-Made Additives for Controlling Nucleation: Case Study of p-Aminobenzoic Acid Crystallizing from Ethanolic Solutions

PL Kaskiewicz, I Rosbottom, RB Hammond… - Crystal Growth & …, 2021 - ACS Publications
A workflow for tailor-made additive screening and crystallization control using a combination
of molecular modeling and experimental techniques is presented. The impact of seven …