Computational redesign of human butyrylcholinesterase for anticocaine medication

Yongmei Pan, Daquan Gao, Wen‐Chao Yang, +4

Proceedings of the National Academy of Sciences

Most Efficient Cocaine Hydrolase Designed by Virtual Screening of Transition States

Fang Zheng, Wen‐Chao Yang, Mei‐Chuan Ko, +7

Journal of the American Chemical Society

Short chain and medium chain fatty acids production using food waste under non-augmented and bio-augmented conditions

M. Venkateswar Reddy, Satoru Hayashi, DuBok Choi, +2

Journal of Cleaner Production

EngineeringOmega-3 Fatty AcidEnvironmental EngineeringFood WasteFood Waste Management +4

Free Energy Perturbation (FEP) Simulation on the Transition States of Cocaine Hydrolysis Catalyzed by Human Butyrylcholinesterase and Its Mutants

Yongmei Pan, Daquan Gao, Wen‐Chao Yang, +2

Journal of the American Chemical Society

Molecular Dynamics Simulation of Cocaine Binding with Human Butyrylcholinesterase and Its Mutants

Adel Hamza, Hoon Cho, Hsin‐Hsiung Tai, +1

The Journal of Physical Chemistry B

Computational Design of a Human Butyrylcholinesterase Mutant for Accelerating Cocaine Hydrolysis Based on the Transition‐State Simulation

Daquan Gao, Hoon Cho, Wen‐Chao Yang, +4

Angewandte Chemie International Edition

Psychotropic MedicationPsychopharmacologyCocainePharmacotherapyAccelerating Cocaine Hydrolysis +22

Effect of bamboo oil on antioxidative activity and nitrite scavenging activity

DuBok Choi, Ki-An Cho, Myung-Sun Na, +5

Journal of Industrial and Engineering Chemistry

Food ChemistryEnvironmental EngineeringAntioxidative ActivityNitrite Scavenging ActivityPhytochemical +3

Free-Energy Perturbation Simulation on Transition States and Redesign of Butyrylcholinesterase

Wen‐Chao Yang, Yongmei Pan, Fang Zheng, +3

Biophysical Journal

BiochemistryNatural SciencesMolecular BiologyComputational ChemistryQuantum Chemistry +4

Application of Controllable Electric Coolant Pump for Fuel Economy and Cooling Performance Improvement

Hoon Cho, Dohoy Jung, Zoran Filipi, +3

Journal of Engineering for Gas Turbines and Power

Electric Pump SubmodelEngineeringHeat RecoveryEnergy EfficiencyEnergy Management +11

Naphthazarin Derivatives (VI): Synthesis, Inhibitory Effect on DNA Topoisomerase-I and Antiproliferative Activity of 2- or 6-(1-Oxyiminoalkyl)-5,8-dimethoxy-1,4-naphthoquinones

Gyu‐Yong Song, Yong Kim, Youngjae You, +4

Archiv der Pharmazie