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396
Program
| Time | Speakers & Titles |
| 08:15-09:15 | Registration |
| 09:15-09:25 | Opening Remarks (Chao-Ping Hsu) |
| 09:25-09:45 | Ice Breaker (Getting to know each other) |
| Session I | |
| 09:45-10:15 |
Wilfredo C. Chung FIESTA: The Filipino Initiative on Electronic Structure Theory and Applications |
| 10:15-10:25 | TBA |
| 10:25-10:35 | TBA |
| 10:35-11:00 | Coffee Break |
| Session II | |
| 11:00-11:30 |
Ricky B. Nellas Computational approach on understanding the molecular recognition of octopamine receptor for pest control |
| 11:30-11:40 |
Carmay Lim Principles Governing Biological Processes |
| 11:40-11:50 |
Jhih-Wei Chu On the mechanical couplings in dsDNA, dsRNA, and Hybrid Duplexes via Multiscale Molecular Simulation |
| 11:50-12:00 |
Hsiao-Ching Yang Probing Water Microsolvation Dynamics for Understanding of Enzymatic Biosynthesis |
| 12:00-12:30 |
Gil C. Claudio Counterion Distribution and the Gelation Process of iota-Carrageenan via Molecular Dynamics Simulations |
| 12:30-13:30 | Lunch Break |
| Session III | |
| 13:30-14:00 |
Bernhard Egwolf Computing Entropies from High-Dimensional Simulation Data |
| 14:00-14:10 |
Ying-Chieh Sun Computer Simulation of Protein-ligand Complexes: MD and Docking Simulations |
| 14:10-14:20 |
Kaito Takahashi Water clustering effect towards vibrational, spectra and photodetachment of anions |
| 14:20-14:30 | TBA |
| 14:30-15:00 |
Marvin A. Albao Temperature programmed desorption of CO on W(100) investigated using combined kinetic Monte Carlo simulations and Density Functional Theory |
| 15:00-15:10 | TBA |
| 15:10-15:20 |
Ming-Kang Tsai Multi-perspective Modeling of Computational Inorganic Chemistry |
| 15:20-15:40 | Coffee Break |
| Session IV | |
| 15:40-16:10 |
Melanie Y. David DFT-based study of the Structural and Electronic Properties of Graphitic Hetero-Structures |
| 16:10-16:20 |
Jeng-Da Chai Frontiers in Density Functional Theory and Their Applications to Novel Nanomaterials |
| 16:20-16:30 |
Jyh-Chiang Jiang The Computational Chemistry on Surface Chemistry |
| 16:30-17:00 |
Francis Norman C. Paraan Carbon dioxide adducts with cobalt salen complexes |
| 17:00-17:30 |
Darwin B. Putungan Materials for Energy Conversion and Storage: The Role of Ab-initio Random Structure Searching |
| 17:30-18:30 | Poster Session and informal discussion |
| 18:30-18:45 | Closing Remarks |
