QM/MM (ONIOM) Calculation on FAK/Dasatinib Docking

Revista Processos Químicos
doi 10.19142/rpq.v9i18.259
Full Text
Abstract

Available in full text

Date
Authors
Publisher

Revistas Processos Quimicos

Related search

Investigation of Optoelectronic Properties of N3 Dye-Sensitized TiO2 Nano-Crystals by Hybrid Methods: ONIOM (QM/MM) Calculations

International Nano Letters
MedicineBioengineeringBiomedical EngineeringPharmaceutical Science
2013English

A QM/MM and QM/QM/MM Study of Kerr, Cotton–Mouton and Jones Linear Birefringences in Liquid Acetonitrile

Physical Chemistry Chemical Physics
Theoretical ChemistryAstronomyPhysicsPhysical
2018English

Accurate Prediction of Protein-Ligand Binding by Combined Molecular Dynamics-Based Docking and QM/MM Methods

Biophysical Journal
Biophysics
2018English

Role of Mg2+ and Ca2+ in DNA Bending: Evidence From an ONIOM-Based QM-MM Study of a DNA Fragment

English

The Binding Mode of the Sonic Hedgehog Inhibitor Robotnikinin, a Combined Docking and QM/MM MD Study

Frontiers in Chemistry
Chemistry
2017English

On the Difference Between Additive and Subtractive QM/MM Calculations

Frontiers in Chemistry
Chemistry
2018English

Classical Polarization in Hybrid QM/MM Methods

English

QM/MM Study of the Taxadiene Synthase Mechanism

Journal of Computational Chemistry
Computational MathematicsChemistry
2019English

Vibrational Analysis of Boldine Hydrochloride Using QM/MM Approach

Spectroscopy
2010English

Amanote Research

Note-taking for researchers

Follow Amanote

© 2025 Amaplex Software S.P.R.L. All rights reserved.

Privacy PolicyRefund Policy