講座：MOE 2022亞太ZOOM在線用戶會(huì)議

October 13^{th (Thursday)}

Time

Title

Speaker

Language

12:00 - 12:10

Opening remarks

Junichi Goto, 

MOLSIS Inc.

Japanese

12:10 - 12:30

MOE Overview

Kentaro Kamiya, 

MOLSIS Inc.

Japanese

12:30 - 13:00

[Invited talk]

Genomic Medicine with MOE ~Examples in Rare and Intractable Disease Research~

(Abstract is in preparation)

Kazuhito Satou,

The National Center for Child Health and Development

Japanese

13:00 - 13:30

[Invited talk]

Extracting protein dynamics from cryo-EM density maps by combining MD simulations and a machine learning technique

(Abstract )

Shigeyuki Matsumoto,

Kyoto University

Japanese

13:30 - 13:45

Break

－

－

13:45 - 14:15

[Invited talk]

Antibody humanization and Developability Research in MOE

(Abstract )

Di Lu,

Fapon Biopharma Inc.

Chinese

14:15 - 14:45

[Invited talk]

Medicinal Chemistry driven strategies toward novel modulators targeting Tumor Immunity-Metabolism

(Abstract )

Jinlei Bian,

China Pharmaceutical University

Chinese

14:45 - 15:00

Break

－

－

15:00 - 16:00

MOE and PSILO demo

Yoshirou Kimura,

MOLSIS Inc.

Japanese

16:00 - 16:05

Closing on the first day

－

－

October 14^{th (Friday)}

8:00 - 8:30

Structure-Based Charge Calculations for Predicting Properties and Profiling Antibody Therapeutics

(Abstract ）

Nels Thorsteinson,

Chemical Computing Group ULC

English

8:30 - 9:00

Reverse Fingerprinting: Application to Motif Detection and Pharmacophore Query Generation

(Abstract )

Chris Williams,

Chemical Computing Group ULC

English

9:00 - 9:30

MOE 2022.02 and PSILO 2022.0201 Release Overview

Andrew Henry,

Chemical Computing Group ULC

English

9:30 - 9:40

Break

－

－

9:40 - 11:00

Posters & Social Interactions

(in oVice virtual space)

－

－

11:00 - 12:00

Break

－

－

12:00 - 12:30

[Invited talk]

Development of potent PROTAC molecules via in silico design

(Abstract )

Yosuke Demizu,

National Institute of Health Sciences

Japanese

12:30 - 13:00

[Invited talk]

In silico enzyme design for bioproduction of valuable compounds

(Abstract ）

Yutaro Mori,

RIKEN

Japanese

13:00 - 13:30

Introduction to MOE biologics applications

(Abstract )

Takashi Ikegami,

MOLSIS Inc.

Japanese

13:30 - 13:45

Break

－

－

13:45 - 14:15

[Invited talk]

Functional analysis of natural product biosynthetic enzymes based on homology modeling

(Abstract ）

Koji Ichinose,

Musashino University

Japanese

14:15 - 14:45

[Invited talk]

A local QSAR model based on the stability of nitrenium ions to support the ICH M7 expert review on the mutagenicity of primary aromatic amines

(Abstract )

Satoshi Ono,

Mitsubishi Tanabe Pharma Corporation

Japanese

14:45 - 14:50

Closing

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