QUANTUM DRUG DOCKING

Molecular Dynamics & AI-Powered Binding Prediction

Target Proteins

SARS-CoV-2 Spike
Viral entry protein
ACE2 Receptor
Host cell receptor
HIV Protease
Viral enzyme
EGFR Kinase
Cancer target
β-Tubulin
Microtubule protein
RNA Polymerase
Transcription enzyme

Drug Candidates

Remdesivir
Antiviral
MW: 602.6 | LogP: 1.9
Paxlovid
Protease inhibitor
MW: 499.5 | LogP: 2.1
Oseltamivir
Neuraminidase inhibitor
MW: 312.4 | LogP: 1.2
Imatinib
Kinase inhibitor
MW: 493.6 | LogP: 3.0
Paclitaxel
Tubulin stabilizer
MW: 853.9 | LogP: 3.5
Doxorubicin
DNA intercalator
MW: 543.5 | LogP: 1.3
QUANTUM STATE
IDLE

Docking Controls

Binding Affinity

Binding Energy
0.0 kcal/mol
Kd (Dissociation)
-- nM
RMSD
0.0 Å
H-Bonds
0
Hydrophobic
0
Affinity Score
--