Research graph
References from Cyclophosphamide adsorption in FAU zeolites: GCMC insights into strength-capacity trade-off and diffusion dynamics. Local targets link to admitted publications; unresolved targets remain external evidence.
A density functional theory study of cyclophosphamide and purinethol adsorption on a covalent triazine framework (CTF-2) for drug delivery applications
10.1038/s41598-026-36405-5 · 2026 · External reference
An overview of cyclophosphamide development and clinical applications
10.2174/1381612805666230110214512 · 1999 · External reference
Cyclophosphamide injection: Prescribing information
2024 · External reference
Tackling water contamination by oncologic drugs: Supported ionic liquids as sustainable adsorbents for cyclophosphamide removal
10.1016/j.jenvman.2024.122995 · 2024 · External reference
Drug delivery systems based on inorganic materials: I. Synthesis and characterization of a zeolite-cyclophosphamide system
10.1163/156856294x00572 · 1994 · External reference
Cyclophosphamide adsorption on the surface of polyethylene glycol: A computational study
10.1134/s0036024425701936 · 2025 · External reference
Encapsulation and surface adsorption of cyclophosphamide on pristine and metal-doped BNNTs: A DFT study of structural and electronic modulation
10.1007/s11224-026-02814-5 · 2026 · External reference
Design and DFT/TD-DFT study of cyclophosphamide adsorption on pristine and metal-doped B12N12 nanostructures for targeted drug delivery
2025 · External reference
Tert-butylamine functionalized MCM-41 mesoporous nanoparticles as drug carriers for the controlled release of cyclophosphamide anticancer drug
2021 · External reference
Minimalistic peptide nanocarriers for multiple cancer drugs
2025 · External reference
Adsorption of 5-fluorouracil, an anticancer drug, in faujasite-type zeolites: Understanding storage and release with density functional theory calculations
10.1039/d4ce00344f · 2024 · External reference
Unresolved reference
2007 · External reference
Use of the Grand Canonical Transition-Matrix Monte Carlo method to model gas adsorption in porous materials
2013 · External reference
Research on surface hydrophobic modification and flotation decarbonization of coal gasification fine slag
10.1016/j.cej.2025.172241 · 2026 · External reference
CO₂ bubble-mediated phase interfacial regulation enhances flotation recovery of carbon from low-rank coal
2026 · External reference
Preferential Partitioning of Per- and Polyfluoroalkyl Substances (PFAS) and Dissolved Organic Matter in Freshwater Surface Microlayer and Natural Foam
2026 · External reference
PubChem 2023 update
10.1093/nar/gkac956 · 2023 · External reference
Cyclophosphamide
2025 · External reference
Unresolved reference
2017 · External reference
DFTB simulation of charged clusters using machine learning charge inference
10.1021/acs.jctc.4c00107 · 2024 · External reference
Unresolved reference
External reference
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
10.1063/1.3382344 · 2010 · External reference
Effect of the damping function in dispersion corrected density functional theory
10.1002/jcc.21759 · 2011 · External reference
Performance of dispersion-corrected density functional theory for thermochemistry and non-covalent interactions
2012 · External reference
DFTB+, a software package for efficient approximate density functional theory based atomistic simulations
10.1063/1.5143190 · 2020 · External reference
Zeolite architecture and composition govern selective adsorption of organophosphorus compounds
10.1016/j.ceja.2026.101068 · 2026 · External reference
Structure-property relationships in zeolite adsorption of G-series nerve agents
2026 · External reference
ChemRxiv
2024 · External reference
Unresolved reference
2025 · External reference
Unresolved reference
2026 · External reference
From molecules to solids with the DMol3 approach
10.1063/1.1316015 · 2000 · External reference
COMPASS: An ab Initio Force-Field Optimized for Condensed-Phase Applications - Overview with Details on Alkane and Benzene Compounds
10.1021/jp980939v · 1998 · External reference
Parametrization and benchmark of DFTB3 for organic molecules
10.1021/ct300849w · 2013 · External reference
Parameterization of DFTB3/3OB for sulfur and phosphorus for chemical and biological applications
10.1021/ct401002w · 2014 · External reference
Parameterization of the DFTB3 method for Br, Ca, Cl, F, I, K, and Na in organic and biological systems
10.1021/ct5009137 · 2015 · External reference
Prediction of water adsorption isotherm on 13X zeolite in different temperatures and investigating the effect of non-framework cations using dynamic simulation
10.1016/j.apsadv.2023.100522 · 2023 · External reference
Selectivity of new siliceous zeolites for separation of methane and carbon dioxide by Monte Carlo simulation
10.1016/j.micromeso.2013.03.054 · 2013 · External reference
Hydrophilicity/hydrophobicity of FAU zeolites
2018 · External reference
DFT study of Si/Al ratio and confinement effects on the energetics and vibrational properties of some aza-aromatic molecules adsorbed on H-ZSM-5 zeolite
10.3390/computation8030081 · 2020 · External reference
Impact of octahedral aluminum sites on guest molecule adsorption in zeolites: A computational study of 5-fluorouracil in zeolite FAU
2025 · External reference
Unresolved reference
2014 · External reference
A DFT study on the physical adsorption of cyclophosphamide derivatives on the surface of fullerene C60 nanocage
10.1016/j.jmgm.2014.06.001 · 2014 · External reference
Removal of pharmaceutical contaminants from water by metal-organic frameworks: Adsorption performance and mechanisms
2024 · External reference
Zeolite adsorbents for gas separation and purification: Structure-property relationships and design principles
2021 · External reference
Computational screening of porous materials for gas adsorption and separation
2020 · External reference
