Ingo Muegge - researchr alias

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Viewing Publication 1 - 9 from 9

2022

In Silico Positional Analogue Scanning with Amber GPU-TIYuan Hu, Ingo Muegge. jcisd, 62(18):4448-4459, 2022. [doi]

2017

Computer-aided drug design at Boehringer IngelheimIngo Muegge, Andreas Bergner, Jan M. Kriegl. jcamd, 31(3):275-285, 2017. [doi]

Kinase Crystal Miner: A Powerful Approach to Repurposing 3D Hinge Binding Fragments and Its Application to Finding Novel Bruton Tyrosine Kinase InhibitorsPrasenjit Mukherjee, Jörg Bentzien, Todd Bosanac, Wang Mao, Michael Burke, Ingo Muegge. jcisd, 57(9):2152-2160, September 2017. [doi]

2011

DemQSAR: predicting human volume of distribution and clearance of drugsOzgur Demir-Kavuk, Jörg Bentzien, Ingo Muegge, Ernst-Walter Knapp. jcamd, 25(12):1121-1133, 2011. [doi]

2007

Torsion Angle Preference and Energetics of Small-Molecule Ligands Bound to ProteinsMing-Hong Hao, Omar Haq, Ingo Muegge. jcisd, 47(6):2242-2252, 2007. [doi]

kScore: a novel machine learning approach that is not dependent on the data structure of the training setScott Oloff, Ingo Muegge. jcamd, 21(1-3):87-95, 2007. [doi]

2001

Effect of ligand volume correction on PMF scoringIngo Muegge. jcc, 22(4):418-425, 2001. [doi]

2000

Evaluation of docking/scoring approaches: A comparative study based on MMP3 inhibitorsSookhee Ha, Romana Andreani, Arthur Robbins, Ingo Muegge. jcamd, 14(5):435-448, 2000. [doi]

1993

Model Calculations of Protein-Water Systems anf of Long time Dynamics of ProteinsIngo Muegge, A. Irgens-Defregger, E. W. Knapp. biow 1993: 89-100

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