Current trends in organic chemistry: contribution of the ND Zelinsky Institute of Organic Chemistry of the Russian Academy of Sciences
MP Egorov, VP Ananikov, EG Baskir… - Russian Chemical …, 2024 - Springer
A key goal of organic chemistry is to develop new principles for the control of reactions,
which can be used to create promising materials demanded in all fields of scientific research …
which can be used to create promising materials demanded in all fields of scientific research …
Dealing with Induced Fit, Conformational Selection, and Secondary Poses in Molecular Dynamics Simulations for Reliable Free Energy Predictions
P Procacci - Journal of Chemical Theory and Computation, 2023 - ACS Publications
In this study, we have tested the performance of standard molecular dynamics (MD)
simulations, replicates of shorter standard MD simulations, and Hamiltonian Replica …
simulations, replicates of shorter standard MD simulations, and Hamiltonian Replica …
The Nitro Group Reshapes the Effects of Pyrido[3,4-g]quinazoline Derivatives on DYRK/CLK Activity and RNA Splicing in Glioblastoma Cells
SS Borisevich, TE Aksinina, MG Ilyina, VO Shender… - Cancers, 2024 - mdpi.com
Simple Summary The complex mode of gene expression regulation is a key reason
underlying the biological heterogeneity and clinical diversity of malignant gliomas. In …
underlying the biological heterogeneity and clinical diversity of malignant gliomas. In …
Molecular modeling in synthesis: from statistical methods to quantum chemistry and practical applications
The review gives a retrospective of methods for molecular modeling of the structures,
mechanisms of chemical reactions, and properties of organic compounds. The development …
mechanisms of chemical reactions, and properties of organic compounds. The development …
EMERGING PHARMACOLOGICAL APPLICATIONS OF N-HETEROCYCLES: PYRAZOLES DERIVATIVES, IMIDAZOLE DERIVATIVES, TRIAZOLES DERIVATIVES
DM NAHAR, P MOHITE… - Paving the Path to …, 2024 - books.google.com
This book chapter delves into the burgeoning field of pharmacological applications of N-
heterocycles, focussing particularly on pyrazole, imidazole and triazole derivatives. N …
heterocycles, focussing particularly on pyrazole, imidazole and triazole derivatives. N …