H. C. Stephen Chan

Using <scp>PyMOL</scp> as a platform for computational drug design

Shuguang Yuan, H. C. Stephen Chan, Zhenquan Hu · Wiley Interdisciplinary Reviews Computational Molecular Science · 2017 · 896 citations · Full text

Molecular Biology, Structures Visualization, Molecular Design +21

Towards ab initio screening of co-crystal formation through lattice energy calculations and crystal structure prediction of nicotinamide, isonicotinamide, picolinamide and paracetamol multi-component crystals

H. C. Stephen Chan, John Kendrick, Marcus A. Neumann et al. · CrystEngComm · 2013 · 116 citations · Full text

Crystal Structure, Engineering, Lattice Energy Calculations +17

Molecule VI, a Benchmark Crystal‐Structure‐Prediction Sulfonimide: Are Its Polymorphs Predictable?

H. C. Stephen Chan, John Kendrick, Frank J. J. Leusen · Angewandte Chemie International Edition · 2011 · 58 citations

Crystal Structure, Molecular Dynamics, Engineering +15

Structural and Computational Insight into the Catalytic Mechanism of Limonene Epoxide Hydrolase Mutants in Stereoselective Transformations

Zhoutong Sun, Lian Wu, Marco Bocola et al. · Journal of the American Chemical Society · 2017 · 58 citations · Full text

Engineering, Molecular Biology, Computational Insight +17

The Molecular Mechanism of P2Y₁Receptor Activation

Shuguang Yuan, H. C. Stephen Chan, Horst Vogel et al. · Angewandte Chemie International Edition · 2016 · 57 citations · Full text