Keyword Connections

molecular dynamics simulations

Journals

19

1 Polymers

2 PloS one

3 The Journal of Chemical Physics

4 Nanomaterials (Basel, Switzerland)

5 Journal of chromatographic science

6 International journal of biological macromolecules

7 Chemistry (Weinheim an der Bergstrasse, Germany)

8 Langmuir : the ACS journal of surfaces and colloids

9 pakistan journal of pharmaceutical sciences

10 the journal of physical chemistry b

11 jpma the journal of the pakistan medical association

12 Computational biology and chemistry

13 methods in molecular biology (clifton, nj)

14 Journal of biomolecular structure & dynamics

15 advances in protein chemistry and structural biology

16 hematology/oncology and stem cell therapy

17 Asian Pacific journal of cancer prevention : APJCP

18 Hellenic journal of nuclear medicine

19 protein and peptide letters

Research Groups

0

No Research Group Connected

Bibliographies

31

1 Natural compounds as potential Hsp90 inhibitors for breast cancer-Pharmacophore guided molecular modelling studies.

2 Insight into the mechanism of allosteric activation of PI3Kα by oncoprotein K-Ras4B.

3 Prospecting Potential Inhibitors of Sortase A from Enterococcus faecalis: A Multidrug Resistant Bacteria, through In-silico and In-vitro Approaches.

4 Cellular prion protein gene polymorphisms linked to differential scrapie susceptibility correlate with distinct residue connectivity between secondary structure elements.

5 Molecular-Level "Observations" of the Behavior of Gold Nanoparticles in Aqueous Solution and Interacting with a Lipid Bilayer Membrane.

6 The Composition of the Mobile Phase Affects the Dynamic Chiral Recognition of Drug Molecules by the Chiral Stationary Phase.

7 Aromatic Polyamide Reverse-Osmosis Membrane: An Atomistic Molecular Dynamics Simulation.

8 Simulated Permeation and Characterization of PEGylated Gold Nanoparticles in a Lipid Bilayer System.

9 Trends and Analysis of Cancer Incidence for Common Male and Female Cancers in the Population of Punjab Province of Pakistan during 1984 to 2014.

10 Surface-functionalized nanoparticle permeation triggers lipid displacement and water and ion leakage.

11 Efficacy and safety of sorafenib-gemcitabine combination therapy in advanced hepatocellular carcinoma: an open-label Phase II feasibility study.

12 Communication: A tractable design for a thermal transistor.

13 Preparation of (99m)Tc-labelled methotraxate by a direct labeling technique as a potential diagnostic agent for breast cancer and preliminary clinical results.

14 In house development of (99m)Tc-Rhenium sulfide colloidal nanoparticles for sentinel lymph node detection.

15 Synthesis, characterization and bioevaluation of technetium-99m labeled N-(2-Hydroxybenzyl)-2-amino-2-deoxy-D-glucose as a tumor imaging agent.

16 Development of 99mTc-5-fluorouracil as a potential tumor diagnostic agent.

17 Nanoparticle permeation induces water penetration, ion transport, and lipid flip-flop.

18 Communication: Thermal rectification in liquids by manipulating the solid-liquid interface.

19 Note: the role of external electric fields in enhancing ion mobility, drift velocity, and drift-diffusion rates in aqueous electrolyte solutions [J. Chem. Phys. 134, 114504 (2011)].

20 The role of external electric fields in enhancing ion mobility, drift velocity, and drift-diffusion rates in aqueous electrolyte solutions.

21 Influence of hydrophilic surface specificity on the structural properties of confined water.

22 Post mastectomy adjuvant radiotherapy in breast cancer: a comparision of three hypofractionated protocols.

23 Latest trends in structure based drug design with protein targets.

24 Solvophobically Driven Complexation of Adamantyl Mannoside with β-Cyclodextrin in Water and Structured Organic Solvents.

25 ion clusters and ion-water potentials in md-simulations

26 free energy, enthalpy and entropy from implicit solvent end-point simulations

27 Molecular-Level Investigation of Cycloaliphatic Epoxidised Ionic Liquids as a New Generation of Monomers for Versatile Poly(Ionic Liquids)

28 Computational studies of DNA repair: Insights into the function of monofunctional DNA glycosylases in the base excision repair pathway

29 Molecular modeling studies demonstrate key mutations that could affect the ligand recognition by influenza AH1N1 neuraminidase

30 The Effect of Mechanical Elongation on the Thermal Conductivity of Amorphous and Semicrystalline Thermoplastic Polyimides: Atomistic Simulations.

31 Thermodynamic Characterization of Polyetherimide/Single-Walled Carbon Nanotube Composites.