Concepedia

CSC01 shows promise as a potential inhibitor of the oncogenic G13D mutant of KRAS: an in silico approach

Olanrewaju Ayodeji Durojaye, Umer Ejaz, Henrietta Onyinye Uzoeto, Adeola Abraham Fadahunsi, Adebayo Oluwole Opabunmi, Daniel Emmanuel Ekpo, Divine Mensah Sedzro, Mukhtar Oluwaseun Idris

Amino Acids · 2023 · 10 citations · 64 references

DOI

Concepts

References

64

GROMACS: Fast, flexible, and free

David van der Spoel, Erik Lindahl, Berk Hess et al. · Journal of Computational Chemistry · 2005 · 19.1K citations

, , +17

SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

Antoine Daina, Olivier Michielin, Vincent Zoete · Scientific Reports · 2017 · 17.1K citations · Full text

, , +16

Ultrastructural Characterization of the Lower Motor System in a Mouse Model of Krabbe Disease

Valentina Cappello, Laura Marchetti, Paola Parlanti et al. · Scientific Reports · 2016 · 13.3K citations · Full text

, , +17

Protein and ligand preparation: parameters, protocols, and influence on virtual screening enrichments

G. Madhavi Sastry, Matvey Adzhigirey, Tyler Day et al. · Journal of Computer-Aided Molecular Design · 2013 · 6K citations

, , +14

ProTox-II: a webserver for the prediction of toxicity of chemicals

Priyanka Banerjee, Andreas Eckert, Anna K. Schrey · Nucleic Acids Research · 2018 · 3.1K citations · Full text

, , +14