T_SELEX program: Theoretical SELEX tool for Rational Design and Selection of RNA Aptamers Targeting Macromolecules
Predicting Electrocatalytic Urea Synthesis Using a Two-dimensional Descriptor
Theoretical Study on Copper Adsorption on ZnO Surfaces
A computational Analysis of the Proton Affinity and the Hydration of TEMPO and Its Piperidine Analogs
An IROA Workflow for correction and normalization of ion suppression in mass spectrometry-based metabolomic profiling data
LLMs can Design Sustainable Concrete – a Systematic Benchmark
A QSPR analysis and curvilinear regression for various degree-based topological indices of Quinolone antibiotics
Phytochemical Profiling and Molecular Docking Investigation of Avocado (Persea Americana Mill. Cultivar Hass) Leaves and Seeds: Implications for Antioxidant Activity and Health Benefits
Spondias mombin flavonoids showed super-binder ability with Downstream Molecular Targets of Parkinson’s Disease: Folkloric-therapy assessment as a Scaffold for Structural Studies in Neurodegenerative disease
AdductHunter: Identifying Protein-Metal Complex Adducts in Mass Spectra