Results 141 to 150 of about 26,166,385 (205)

Pharmacophore-based virtual screening, molecular docking, and molecular dynamics investigation for the identification of novel, marine aromatase inhibitors. [PDF]

BMC Chem
Kotb MA, Abdelmawgood IA, Ibrahim IM.
europepmc   +1 more source

Identification of novel PAD2 inhibitors using pharmacophore-based virtual screening, molecular docking, and MD simulation studies. [PDF]

Sci Rep
Jha P, Rajoria P, Poonia P, Chopra M.
europepmc   +1 more source

Development of Multi-Target Pharmacophore-Based Virtual Screening Agent Against COVID-19

, 2023
Ibrahim N, Gouda A, El-Sherief H.
europepmc   +1 more source

Non-Extensive Fragmentation of Natural Products and Pharmacophore-Based Virtual Screening as a Practical Approach to Identify Novel Promising Chemical Scaffolds. [PDF]

Front Chem, 2021
Vásquez AF, Muñoz AR, Duitama J, González Barrios A.   +3 more
europepmc   +1 more source

Pharmacophore-based virtual screening and <i>in silico</i> investigations of small molecule library for discovery of human hepatic ketohexokinase inhibitors for the treatment of fructose metabolic disorders. [PDF]

Front Pharmacol
Elsaman T, Mohamed MA, Elderdery AY, Alsrhani A, Alzahrani B, Ghanem HB, Mills J, Rayzah M, Alzerwi NAN, Al-Sultan A, Idrees B, Rayzah F.   +11 more
europepmc   +1 more source

Quinazoline-2,4(1H,3H)-dione derivatives as new class of CB1 Agonists: A pharmacophore-based virtual screening workflow and drug discovery. [PDF]

F1000Res
El Aissouq A, Stitou M, Enneiymy M, El Rhabori S, Zaitan H, Ouammou A, Khalil F.   +6 more
europepmc   +1 more source

Pharmacophore-based virtual screening of commercial databases against β-secretase 1 for drug development against Alzheimer's disease. [PDF]

Front Chem
Han X, Guo K.
europepmc   +1 more source

Using Chou's 5-steps rule to study pharmacophore-based virtual screening of SARS-CoV-2 Mpro inhibitors. [PDF]

Mol Divers, 2021
Pundir H, Joshi T, Joshi T, Sharma P, Mathpal S, Chandra S, Tamta S.   +6 more
europepmc   +1 more source

Insilico exploration C. koseri ATP synthase inhibitors by pharmacophore-based virtual screening, molecular docking and MD simulation. [PDF]

PLoS One
Alanzi AR, A Z A, Alhazzani K.
europepmc   +1 more source

Integration of pharmacophore-based virtual screening, molecular docking, ADMET analysis, and MD simulation for targeting EGFR: A comprehensive drug discovery study using commercial databases. [PDF]

PLoS One
Alanzi AR, Moussa AY, Alsalhi MS, Nawaz T, Ali I.   +4 more
europepmc   +1 more source