Yamil Simón‐Manso

Metabolite Profiling of a NIST Standard Reference Material for Human Plasma (SRM 1950): GC-MS, LC-MS, NMR, and Clinical Laboratory Analyses, Libraries, and Web-Based Resources

Yamil Simón‐Manso, Mark S. Lowenthal, Lisa E. Kilpatrick et al. · Analytical Chemistry · 2013 · 299 citations

Biological Mass Spectrometry, Metabolomic Profiling, Nist Srm 1950 +23

On the Density Functional Relationship between Static Dipole Polarizability and Global Softness

Yamil Simón‐Manso, Patricio Fuentealba · The Journal of Physical Chemistry A · 1998 · 112 citations · Full text

Engineering, Computational Chemistry, Density Functional Relationship +16

Molecular Electronic Excitations and the Minimum Polarizability Principle

Patricio Fuentealba, Yamil Simón‐Manso, Pratim Kumar Chattaraj · The Journal of Physical Chemistry A · 2000 · 99 citations · Full text

Localized Excited State, Engineering, Magnetic Resonance +16

Empirical Energy−Density Relationships for the Analysis of Substituent Effects in Chemical Reactivity

Patricia Pérez, Yamil Simón‐Manso, Arie Aizman et al. · Journal of the American Chemical Society · 2000 · 94 citations · Full text

Engineering, Chemical Analysis, Computational Chemistry +17

Hybrid Search: A Method for Identifying Metabolites Absent from Tandem Mass Spectrometry Libraries

Brian T. Cooper, Xinjian Yan, Yamil Simón‐Manso et al. · Analytical Chemistry · 2019 · 68 citations · Full text

Engineering, Identifying Metabolites Absent, Metabolomic Profiling +21