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The Story of Zoliflodacin – A MedChemica Review
Figure 1: The Structure of zoliflodacin Introduction Zoliflodacin
Comp. Chem. Paper of the Month – Nov 2024
Estimating the synthetic accessibility of molecules with building block and
MedChem Paper of the Month – Nov 2024
Development of Brain Penetrant Pyridazine Pantothenate Kinase Activators Med. Chem.2024,
MedChem paper of the month – Oct 2024
N‐Substituted Pyrrole-Based Heterocycles as Broad-Spectrum Filoviral Entry Inhibitors J.
Comp. Chem. Paper of the month – Oct 2024
Prediction of Inhibitory Activity against the MATE1 Transporter via Combined
MedChem paper of the month – Sept 2024
Discovery of JAB-3312, a Potent SHP2 Allosteric Inhibitor for Cancer
Comp. Chem. Paper of the month – Sept 2024
Simulation-driven design of stabilized SARS-CoV-2 spike S2 immunogens During the
MedChem paper of the month – Aug 2024
A Second-Generation Oral SARS-CoV‑2 Main Protease Inhibitor Clinical Candidate for
Comp. Chem. Paper of the Month – Aug 2024
Deriving general structure–activity/selectivity relationship patterns for different subfamilies of cyclin-dependent
Comp. Chem. Paper of the Month – June 2024
One Chiral Fingerprint To Find Them All Markus Orsi &
MedChem paper of the month – June 2024
Identification of Novel, Selective Ataxia-Telangiectasia Mutated Kinase Inhibitors with the
MedChem paper of the month – Dec 2023
The First ATP Competitive Type-III c-MET Inhibitor? In this paper,
Comp. Chem. Paper of the Month – Dec 2023
Modelling P-gp efflux may help us design better molecules
Comp. Chem. Paper of the Month – Nov 2023
Where Old Meets New: Advancements in AlphaFold with Some Help
MedChem paper of the month – Nov 2023
The Importance of Tracking "Missing' Metabolites: How and Why? Throughout
Comp. Chem. Paper of the Month – June 2023
Machine Learning Strategies for Reaction Development: Toward the Low-Data Limit
MedChem paper of the month June 2023
Discovery of an Oral, Beyond-Rule-of-Five Mcl‐1 Protein−Protein Interaction Modulator with
Comp. Chem. Paper of the Month – April 2023
Fast calculation of hydrogen-bond strengths and free energy of hydration
Med Chem – Paper of the Month – Apr 2023
Discovery of the Potent and Selective MC4R Antagonist PF-07258669 for
MCPairs v1.9 release, featuring CoreDesign®
MCPairs v1.9 release is automatically available to all users: MCPairs
Med Chem. Paper of the Month – Feb 2023
Med Chem Paper of the Month – Jan/Feb 2023 This
Comp. Chem. Paper of the Month – Feb 2023
A Review of Computational Approaches Targeting SARS-CoV-2 Main
Beyond Rule of Five – A MedChemica Review
Recent bRo5 publications Figure 1: Picture summarising the limitations of obeying
Comp. Chem. Paper of the Month – Dec 2022
Exposing the Limitations of Molecular Machine Learning with Activity Cliffs
Med Chem Paper of the Month – Dec 2022
Design and Structural Optimization of Orally Bioavailable SOS1 Inhibitors for