I will perform computational chemistry and molecular modeling

I will support computational chemistry and molecular modeling projects with a clearly defined, reproducible workflow tailored to your research question.

Possible services include molecular structure preparation, conformer generation, physicochemical and molecular descriptors, similarity and scaffold analysis, ligand comparison, structure visualization, property tables, and integration of docking, DFT, or MD results supplied by you. Deliverables can include cleaned structures, tables, high-resolution figures, and a concise methods and results summary.

Because projects vary widely, please message me before ordering. Share the molecules, desired analysis, number of compounds, preferred tools or methods, and intended use. I will confirm what is scientifically appropriate and provide a fixed scope.