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Results: 173

Ramon Carbó-Dorca
DNA, unnatural base pairs and hypercubes
J Math Chem, 2018, 56, 1353-1356
DOI: 10.1007/s10910-018-0866-9
Keywords: Molecular similarity

Ramon Carbó-Dorca
Atomic thermal voltage population distributions
J Math Chem, 2018, 56, 1357-1359
DOI: 10.1007/s10910-018-0869-6
Keywords: Molecular similarity

Ramon Carbó-Dorca
Thermal scaling of electronic energy expressions
J Math Chem, 2018, 56, 979-981
DOI: 10.1007/s10910-018-0864-y
Keywords: Molecular similarity

Ramon Carbó-Dorca
Statistical-like signature of molecular basis sets
J Mol Model, 2018, 24, 256
DOI: 10.1007/s00894-018-3794-5
Keywords: Molecular similarity

Mohit Chawla, Albert Poater, Pau Besalú-Sala, Kanav Kalra, Romina Oliva, Luigi Cavallo
Theoretical characterization of sulfur-to-selenium substitution in an emissive RNA alphabet: impact on H-bonding potential and photophysical properties
Phys. Chem. Chem. Phys., 2018, 20, 7676-7685
DOI: 10.1039/C7CP07656H
Keywords: Aromaticity, Chemical bonding, Computational chemistry, Density Functional Theory, Molecular similarity

Andrey A. Toropov, Ramon Carbó-Dorca, Alla P. Toropova
Index of Ideality of Correlation: new possibilities to validate QSAR: a case study
Struct Chem, 2018, 29, 33-38
DOI: 10.1007/s11224-017-0997-9
Keywords: Molecular similarity

Ramon Carbó-Dorca
Quantum polyhedra, definitions, statistics and the construction of a collective quantum similarity index
J Math Chem, 2015, 53, 171-182
DOI: 10.1007/s10910-014-0419-9
Keywords: Molecular similarity

Ramon Carbó-Dorca
Coulomb repulsion, point-like nuclear charges, Dirac paradox, soft nuclear charge density and hypermultiplet nuclear repulsion
J. Math. Chem., 2015, 53, 590-603
DOI: 10.1007/s10910-014-0436-8
Keywords: Molecular similarity

Ramon Carbó-Dorca, Emili Besalú
EMP as a similarity measure: a geometric point of view
J Math Chem, 2013, 51, 382-389
DOI: 10.1007/s10910-012-0089-4
Keywords: Molecular similarity

Ramon Carbó-Dorca, Emili Besalú
Function extended spaces
J Math Chem, 2013, 51, 660-671
DOI: 10.1007/s10910-012-0110-y
Keywords: Molecular similarity

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