Open AccessComputational investigation of unsaturated ketone derivatives as MAO-B inhibitors by using QSAR, ADME/Tox, molecular docking and molecular dynamics simulations
Author(s) -
Abdellah El Aissouq,
Mohammed Bouachrıne,
Abdelkrim Ouammou,
Fouad Khalil
Publication year - 2021
Publication title -
turkish journal of chemistry
Language(s) - English
Resource type - Journals
eISSN - 1303-6130
pISSN - 1300-0527
DOI - 10.3906/kim-2107-63
Subject(s) - chemistry , adme , quantitative structure–activity relationship , ketone , molecular dynamics , docking (animal) , computational chemistry , stereochemistry , combinatorial chemistry , organic chemistry , biochemistry , medicine , nursing , in vitro
Accelerating Research
Robert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom
Address
John Eccles HouseRobert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom