It was noticed that studied PCNPs have different Glide score, Van der Waals energy, and coulomb energy which is apparent due to the structural difference between these natural pigments of same class.
Different bonding interactions are shown in Table 1 while from Table 2 it can be easily anticipated that meridine was best docked to CDK-6 with Glide energy of -44.78, Van der Waals energy of -41.76, and coulomb energy of -3.02.
Docking results clearly judged meridine (best Glide score, maximum H-bonds, and promising Van der Waals and coulomb energy between the ligand and receptor) to be a promising PCNP and it could be considered as potential "lead molecule" for the development of novel anticancer drugs.
Since our interest here is in estimating the lowest-order correction to the Coulomb energy
, we will retain only the leading quadratic term in expression (22).
The two last terms in (2) are respectively due to the smooth part of the pairing energy and the correction of the Coulomb energy to account for the diffuseness of the nucleus surface.
The last correction to the Coulomb energy takes into account that the liquid drop has not a sharp but a diffuse surface of the Woods-Saxon type.
The Hamiltonian was simplified by linearising the intra-atomic Coulomb interaction with the Hartree-Fock approximation then the f-electron band energy was [E.sub.k] = [[epsilon].sub.f] + [Un.sub.[sigma]], where [[epsilon].sub.f] was bare f-electron energy and [Un.sub.[sigma]] was the Coulomb energy
Subjects include: solving semantic interoperability conflicts in cross-border e-government services, the Berlin SPARQL benchmark, OWL class expressions, a new similarity measure for automatic construction of the unknown word lexical dictionary, scalable authoritative OWL reasoning for the Web, linked data and community-driven consolidated linked data, idea ontology for innovation management, and inductive classification of semantically annotated resources through reduced Coulomb energy
Among specific topics are super-heavy and giant nuclear systems, an experimental program with rare-isotope beams at the international Facility for Antiproton and Ion Research (FAIR), quantum Monte Carlo calculations of light nuclei, tests of clustering in light nuclei and applications to nuclear astrophysics, shell-model calculations with low-momentum realistic interactions, studying nuclear structure by means of Coulomb energy
differences, symmetry and super-symmetry in nuclear physics, and the microscopic study of multi-photon excitations in nuclei.
Among the theoretical works, Brown, Preston, and Singleton (BPS) produced an analytic calculation for Coulomb energy
exchange processes for a fusion plasma [9, 16, 17].