Synergy of solid-state NMR, single-crystal X-ray diffraction, and crystal structure prediction methods: a case study of teriflunomide (TFM)
T Pawlak, I Sudgen, G Bujacz, D Iuga… - Crystal Growth & …, 2021 - ACS Publications
In this work, for the first time, we present the X-ray diffraction crystal structure and spectral
properties of a new, room-temperature polymorph of teriflunomide (TFM), CSD code …
properties of a new, room-temperature polymorph of teriflunomide (TFM), CSD code …
Theory and computation of nuclear shielding
T Kupka - 2020 - books.rsc.org
A review of the literature published from January to December 2019 on theoretical aspects
of nuclear magnetic shielding is presented. It covers both non-relativistic and relativistic …
of nuclear magnetic shielding is presented. It covers both non-relativistic and relativistic …
[HTML][HTML] New salts of teriflunomide (TFM)–Single crystal X-ray and solid state NMR investigation
T Pawlak, P Paluch, R Dolot, G Bujacz… - Solid State Nuclear …, 2022 - Elsevier
New salts of teriflunomide TFM (drug approved for Multiple Sclerosis treatment) with
inorganic counterions: lithium (TFM_Li), sodium (TFM_Na), potassium (TFM_K), rubidium …
inorganic counterions: lithium (TFM_Li), sodium (TFM_Na), potassium (TFM_K), rubidium …
Deciphering the Conformations of Glutathione Oxidized Peptide: A Comparative NMR Study in Solution and Solid‐State Environments
DK Senapati, JR Yarava… - Magnetic …, 2025 - Wiley Online Library
Glutathione (GSH) and its oxidized dimer (GSSG) play an important role in living systems as
an antioxidant, balancing the presence of reactive oxygen species (ROS). The central thiol …
an antioxidant, balancing the presence of reactive oxygen species (ROS). The central thiol …
Monitoring the Site-Specific Solid-State NMR Data in Oligopeptides
J Czernek, J Brus - International Journal of Molecular Sciences, 2020 - mdpi.com
Reliable values of the solid-state NMR (SSNMR) parameters together with precise structural
data specific for a given amino acid site in an oligopeptide are needed for the proper …
data specific for a given amino acid site in an oligopeptide are needed for the proper …
[PDF][PDF] Methods to Aid Robust Structural Characterisation Using Nuclear Magnetic Resonance Spectroscopy
C EVANS - 2023 - etheses.dur.ac.uk
The structural assignment of organic molecules in spectroscopy underpins our
understanding of their related physical and chemical properties. This is particularly …
understanding of their related physical and chemical properties. This is particularly …
Proline et prolinol: azacycles prototypiques pour le développement de peptidomimétiques et la synthèse d'agents médicinaux
JB Garsi - 2023 - papyrus.bib.umontreal.ca
La proline est un acide aminé unique qui se caractérise par un cycle pyrrolidine qui lui
confère des propriétés physiques et chimiques spécifiques comparé aux autres 20 acides …
confère des propriétés physiques et chimiques spécifiques comparé aux autres 20 acides …
Solid state NMR spectroscopy
AE Aliev - 2022 - books.rsc.org
This solid-state NMR report summarises the subject and results of 250 articles and original
papers published in 2021. In addition to the published reviews, the two major sections in this …
papers published in 2021. In addition to the published reviews, the two major sections in this …