Keyword Connections

md simulations

Journals

4

1 European journal of medicinal chemistry

2 journal of molecular graphics & modelling

3 Viruses

4 Journal of chemical information and modeling

Research Groups

0

No Research Group Connected

Bibliographies

8

1 Docking structurally similar analogues: Dealing with the false-positive.

2 Molecular Mechanism of Evolution and Human Infection with SARS-CoV-2.

3 Brick-CFCMC: Open Source Software for Monte Carlo Simulations of Phase and Reaction Equilibria Using the Continuous Fractional Component Method.

4 predicting the origins of anti-blood group antibody specificity: a case study of the abo a- and b-antigens

5 mechanical and structural investigation of porous bulk metallic glasses

6 New nimesulide derivatives with amide/sulfonamide moieties: Selective COX-2 inhibition and antitumor effects.

7 Impact of the Position of the Chemically Modified 5-Furyl-2′-Deoxyuridine Nucleoside on the Thrombin DNA Aptamer–Protein Complex: Structural Insights into Aptamer Response from MD Simulations

8 The effect of stress state and He concentration on the dislocation loop evolution in Ni superalloy irradiated by Ni<sup>+</sup> & He<sup>+</sup> dual-beam ions: In-situ TEM observation and MD simulations