All Stories

  1. Integrated computational biophysics approach for drug discovery against Nipah virus
  2. Molecular Docking in Drug Discovery: Techniques, Applications, and Advancements
  3. Exploring the potential of boron-nitride nanobelts in environmental applications: Greenhouse gases capture
  4. Molecular Docking in Drug Discovery: Techniques, Applications, and Advancements
  5. Möbius boron–nitride nanobelts interacting with heavy metal nanoclusters
  6. Attacking the SARS-CoV-2 Replication Machinery with the Pathogen Box’s Molecules
  7. Functionalized boron–nitride nanotubes: First-principles calculations
  8. The Construction of the Tower of Pisa as a Basis for Problem-Solving in the Exact Sciences and the Use of Interdisciplinarity in Teaching
  9. First-principles calculations of nickel, cadmium, and lead nanoclusters adsorption on single-wall (10,0) boron-nitride nanotube
  10. Glycosylation as a key for enhancing drug recognition into spike glycoprotein of SARS-CoV-2
  11. Natural Resources for Human Health: A New Interdisciplinary Journal Dedicated to Natural Sciences
  12. Repurposing potential of Ayurvedic medicinal plants derived active principles against SARS-CoV-2 associated target proteins revealed by molecular docking, molecular dynamics and MM-PBSA studies
  13. Camu-camu (Myrciaria dubia) seeds as a novel source of bioactive compounds with promising antimalarial and antischistosomicidal properties
  14. Attacking the SARS-CoV-2 Replication Machinery with the Pathogen Box’s Molecules
  15. Natural Products as Potential Inhibitors for SARS-CoV-2 Papain-Like Protease: An in Silico Study
  16. Novel multi-epitope protein containing conserved epitopes from different Leishmania species as potential vaccine candidate: Integrated immunoinformatics and molecular dynamics approach
  17. Búsqueda de fármacos, por técnicas de detección virtual, contra virus emergentes.
  18. Dynamics of hydroxyapatite and carbon nanotubes interaction
  19. PQM130, a Novel Feruloyl–Donepezil Hybrid Compound, Effectively Ameliorates the Cognitive Impairments and Pathology in a Mouse Model of Alzheimer’s Disease
  20. Corrigendum to “The addition of inulin and Lactobacillus casei 01 in sheep milk ice cream” [Food Chem. 246 (2018) 464–472]
  21. In silico development of new acetylcholinesterase inhibitors
  22. The addition of inulin and Lactobacillus casei 01 in sheep milk ice cream
  23. Computational Approach to the Discovery of Phytochemical Molecules with Therapeutic Potential Targets to the PKCZ protein
  24. Design, synthesis and pharmacological evaluation of N -benzyl-piperidinyl-aryl-acylhydrazone derivatives as donepezil hybrids: Discovery of novel multi-target anti-alzheimer prototype drug candidates
  25. Effects of surface functionalization on the electronic and structural properties of carbon nanotubes: A computational approach
  26. Influence of Carbon Nanotubes in Nano-carboapatite
  27. Lattice dynamics of carbon nanotube interacting with hydroxyapatite
  28. Synthesis, characterization and theoretical study in gaseous and solid phases of the imine 4-Acetyl- N -(4-methoxybenzylidene)aniline
  29. Electronic properties of disordered functionalized carbon nanotubes
  30. Computer aidded design of new inhibitors of acetylcholinesterase.
  31. Design, Synthesis, Biological Evaluation and Molecular Modeling Studies of Novel Eugenol Esters as Leishmanicidal Agents
  32. Order–disorder phase transition induced by proton transfer in a co-crystal of 2,4-dichlorobenzoic acid and trimethylamine N-oxide
  33. De Novo Design of New Inhibitor of Mutated Tyrosine-Kinase for the Myeloid Leukemia Treatment
  34. β-Galactosidase - Excipients Interaction by Docking Simulation Studies
  35. In silico development of new acetylcholinesterase inhibitors
  36. In Silico Design of New Drugs for Myeloid Leukemia Treatment
  37. Exploring the System Lanthanide/Succinate in the Formation of Porous Metal–Organic Frameworks: Experimental and Theoretical Study
  38. Morelloflavone and its semisynthetic derivatives as potential novel inhibitors of cysteine and serine proteases
  39. First-principles calculations of nickel, cadmium, and lead adsorption on a single-walled (10,0) carbon nanotube
  40. Interactions of lead with carboxyl and hydroxyl-decorated(10, 0) single-walled carbon nanotubes: First-principle calculations
  41. Mangiferin binding to serum albumin is non-saturable and induces conformational changes at high concentrations
  42. Elastic and optical properties of Cu2ZnSn(SexS1 −x)4alloys: density functional calculations
  43. Inhibition of cysteine proteases by a natural biflavone: behavioral evaluation of fukugetin as papain and cruzain inhibitor
  44. Semisynthesis and antimicrobial activity of novel guttiferone-A derivatives
  45. Structural Bioinformatics Approach of Cyclin-Dependent Kinases 1 and 3 Complexed with Inhibitors
  46. Natural polyprenylated benzophenones inhibiting cysteine and serine proteases
  47. Crystal Structure of Garciniaphenone and Evidences on the Relationship between Keto-Enol Tautomerism and Configuration
  48. Dispersion of confined optical phonons in semiconductor nanowires in the framework of a continuum approach
  49. Confined polar optical phonons in semiconductor double heterostructures: an improved continuum approach
  50. Electric-field inversion asymmetry: Rashba and Stark effects for holes in resonant tunneling devices
  51. The temperature dependence of electrical and optical properties in InAs/GaAs and GaAs/InAs/AlAs self-assembled quantum dots
  52. Influence of minority carrier transport in the optical properties of double barrier diodes
  53. Voltage-controlled hole spin injection in nonmagneticGaAs∕AlAsresonant tunneling structures
  54. Negative charged excitons in double barrier diodes
  55. The dynamics of excitons and trions in resonant tunneling diodes
  56. Charge buildup effects in asymmetric p-type resonant tunneling diodes
  57. Kinetics of excitonic complexes on tunneling devices
  58. Trion Assisted Tunneling In Double Barrier Diodes
  59. Photocurrent and photoluminescence studies of resonant tunneling diodes
  60. Efficiencies in multiquantum well lasers
  61. The coherence of the AlGaAs–GaAs phonon laser
  62. GaAs − Al x Ga 1 − x As double-barrier heterostructure phonon laser: A full quantum treatment
  63. The operation threshold of a double barrier phonon laser
  64. A double-barrier heterostructure generator of terahertz phonons: many-body effects
  65. A quantum formalism for a terahertz acoustic laser
  66. Calculation of the thermal resistance and temperature distribution in blue - green semiconductor lasers
  67. Cavity length dependence of the peak conversion efficiency in AlGaAs lasers