Decarboxylation of glycine on icy grain surfaces: a first-principle investigation
Much effort has been devoted to the investigation of the reactivity of glycine, the smallest
amino acid, in different environments in the interstellar medium (ISM). While the formation …
amino acid, in different environments in the interstellar medium (ISM). While the formation …
What Rules the Relative Stability of α-, β-, and γ-Glycine Polymorphs?
NF Xavier Jr, AM da Silva Jr… - Crystal Growth & …, 2020 - ACS Publications
Theoretical calculations based on the density functional theory, using the PBE functional
with the D3 dispersion correction under periodic boundary conditions, have been employed …
with the D3 dispersion correction under periodic boundary conditions, have been employed …
Chemical mechanism for the decomposition of CH3NH2 and implications to interstellar glycine
DN de Jesus, JMBA da Silva, TN Tejero… - Monthly Notices of …, 2021 - academic.oup.com
Complex organic molecules from extraterrestrial source are expected to have contributed to
the Early Earth chemistry. Methylamine (CH3NH2) has already been observed in the …
the Early Earth chemistry. Methylamine (CH3NH2) has already been observed in the …
Intermolecular hydrogen bonding behavior of amino acid radical cations
I Moppel, BA Elliott, S Chen - Organic & Biomolecular Chemistry, 2024 - pubs.rsc.org
Amino acid and peptide radicals are of broad interest due to their roles in biochemical
oxidative damage, pathogenesis and protein radical catalysis, among others. Using density …
oxidative damage, pathogenesis and protein radical catalysis, among others. Using density …
Structure, stability, and spectroscopic properties of small acetonitrile cation clusters
Ionization and fragmentation pathways induced by ionizing agents are key to understanding
the formation of complex molecules in astrophysical environments. Acetonitrile (CH3CN) …
the formation of complex molecules in astrophysical environments. Acetonitrile (CH3CN) …
Determination of the Cohesive Properties and Sublimation Temperatures of Glycine Polymorphs
The experimental data of sublimation properties is limited to important materials,
encouraging the development and assessment of theoretical models. Here, such properties …
encouraging the development and assessment of theoretical models. Here, such properties …
Elementary reactions for glycine production in hot and dense interstellar media from , HCOOH, and
Context In this work, we investigate three elementary reactions involved in the production of
glycine in the interstellar medium (ISM) employing trustworthy electronic structure and …
glycine in the interstellar medium (ISM) employing trustworthy electronic structure and …
Formation of aminomethanol in ammonia-water interstellar ice
Aminomethanol is an important precursor of interstellar glycine. A two-step formation
pathway has been proposed for aminomethanol in interstellar ice via reaction between CH+ …
pathway has been proposed for aminomethanol in interstellar ice via reaction between CH+ …
Dynamics and mechanisms of nonradiative photodissociation of glycine: A theoretical study
J Nirasok, P Panajapo, P Promma… - … of Photochemistry and …, 2023 - Elsevier
Photochemistry of small biomolecules is fundamental to understand the photochemical
reactions of larger molecules, such as proteins. In this work, the dynamics and mechanisms …
reactions of larger molecules, such as proteins. In this work, the dynamics and mechanisms …
Quantum chemistry and metadynamics study of kinetic routes to alanine formation by CO or CO2 insertions in E- or Z-ethanimine isomers
MAR Nogueira-da-Silva, ND Coutinho… - … Lincei. Scienze Fisiche …, 2023 - Springer
Investigations of the synthesis of amino acids are crucial to the understanding of the
chemical evolution of life and are of applied interest in biochemistry and pharmaceutical …
chemical evolution of life and are of applied interest in biochemistry and pharmaceutical …