Results 311 to 320 of about 2,378,379 (395)

Comparative Analysis of Quantum-Mechanical and Standard Single-Structure Protein-Ligand Scoring Functions with MD-Based Free Energy Calculations. [PDF]

J Chem Inf Model
Jalaie M, Fanfrlík J, Pecina A, Lepšík M, Řezáč J.   +4 more
europepmc   +1 more source

Molecular Machine Learning Approach to Enantioselective C-H Bond Activation Reactions: From Generative AI to Experimental Validation. [PDF]

Chem Sci
Hoque A, Chang T, Yu JQ, Sunoj RB.
europepmc   +1 more source

Commentary on differential impact of TIM-3 ligands on NK cell function. [PDF]

J Immunother Cancer
van de Ven R.
europepmc   +1 more source

Emerging Trends in the Coordination Chemistry of Thiazolidinone-Containing Polydentate Ligands: Unconventional Binding Modes in Silver Complexes. [PDF]

Inorg Chem
Corredoira-Vázquez J, Saa M, García-Santos I, Castiñeiras A, Fondo M.   +4 more
europepmc   +1 more source

Dynamic combinatorial chemistry directed by proteins and nucleic acids: a powerful tool for drug discovery.

Chem Soc Rev
Aguanell A, Hennebelle M, Ortega MÁ, Pérez-Fernández R.   +3 more
europepmc   +1 more source