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Digit systems over commutative rings
(World Scientific Publ Co Pte Ltd, 2014-09-01)
Let epsilon be a commutative ring with identity and P is an element of epsilon[x] be a polynomial. In the present paper we consider digit representations in the residue class ring epsilon[x]/(P). In particular, we are ...
Digit systems over commutative rings
(World Scientific Publ Co Pte Ltd, 2015)
Reduced density matrices in molecular systems: Grand-canonical electron states
(American Institute of Physics, 2013-11)
Grand-canonical like descriptions of many electron atomic and molecular open systems which are characterized by a non-integer number of electrons are presented. Their associated reduced density matrices (RDMs) are obtained ...
Digit systems over commutative rings
(World Scientific Publ Co Pte Ltd, 2015)
Canonical forms for isomorphic and equivalent RDF graphs: algorithms for leaning and labelling blank nodes
(ASSOC COMPUTING MACHINERY, 2017)
Existential blank nodes greatly complicate a number of fundamental operations on RDF graphs. In particular,
the problems of determining if two RDF graphs have the same structure modulo blank node labels (i.e. if they
are ...
The HSAB principle from a finite temperature grand‑canonical perspective
(Springer, 2017)
We provide a new proof for Pearson’s hard/
soft acid/base (HSAB) principle. Unlike alternative proofs,
we do not presuppose a simplified parabolic dependence
on the energy of the system with respect to changes in ...
On the non‑integer number of particles in molecular system domains: treatment and description
(Springer, 2015-12)
The energy of an atomic or molecular systemundergoing Coulomb interactions is well known atthe integer numbers of its neutral or ionic configurations.Nevertheless, the physical domains (atoms in molecules)inside the whole ...
The HSAB principle from a finite-temperature grand-canonical perspective
(Springer New York LLC, 2017)
© 2017, Springer-Verlag GmbH Germany.We provide a new proof for Pearson’s hard/soft acid/base (HSAB) principle. Unlike alternative proofs, we do not presuppose a simplified parabolic dependence on the energy of the system ...
Machine learning reveals a non‐canonical mode of peptide binding to MHC class II molecules
(Wiley Blackwell Publishing, Inc, 2017-10)
MHC class II molecules play a fundamental role in the cellular immune system: they load short peptide fragments derived from extracellular proteins and present them on the cell surface. It is currently thought that the ...
A nonequilibrium statistical grand-canonical ensemble: Description in terms of flux operators
(Amer Inst PhysicsMelvilleEUA, 1998)