Please follow links in the program to view full talk abstracts.
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March 2nd, 2019 (Saturday) |
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Conference Venue: Auditorium, CSIR-IICT |
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14:15-14:30 |
Inaugural Session |
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Session 1 |
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Time |
Speakers |
Title of the Talks |
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14:30-14:50 |
Interaction of In silico and Experimental Toxicology | |
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14.50-15:10 |
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15:10-15:30 |
Knowledge-integrated Toxicology and Safety Assessment | |
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15:30-15:40 |
Overview of AMR in the environment and the challenge of assessing risk |
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15:40-15:50 |
The toxicity originating from the reactive metabolites of the drugs |
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15:50-16:30 |
Discussion |
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16:30-16:50 Tea break |
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Session 2 |
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16:50-17:00 |
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17:00-17:10 |
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17:10-17:20 |
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17:20-17:30 |
In silico prediction of toxicity for drugs and yet to be drugs using PASS and Pharmaexpert |
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17:30-18:00 |
Discussion |
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18:00-19:00 |
Poster Evaluation |
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19:00-19:30 |
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20:00-21:00 - Dinner |
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March 3rd, 2019 (Sunday) |
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Conference Venue: Auditorium, CSIR-IICT |
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Session 3 |
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09:00-09:10 |
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09:10-09:20 |
Tuning catalytic reactivity of Iron(IV)-oxo complexes through Induced Steric Effect |
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09:20-09:30 |
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09:30-09:40 |
Structural Characteristics of Disease Molecular Phenotypes | |
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09:40-09:50 |
Computational analysis of mutations allows predicting drug resistance/sensitivity against inhibitors | |
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09:50-10:45 |
Discussion |
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10.45-11:15 Tea break |
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Session 4 |
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11:15-11:25 |
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11:25-11:45 |
Pattern recognition approach to predict a protein’s like or dislike when it meets a metal |
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11:45-11:55 |
Computer simulation of protein-ligand recognition in real time |
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11:55-12:05 |
Adverse outcome pathways – A holistic tool for better predictivity & eliminating animal usage |
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12:05-12:15 |
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12:15-12:25 |
Dr. Priyanka Banerjee |
Development of Toxicity prediction models using chemoinformatics/Machine learning using KNIME workflows |
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12:25-13:15 |
Discussion |
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13:15-14:30 Lunch |
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Session 5 |
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14:30-14:40 |
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14:40-14:50 |
Learning from chemical structures for in silico toxicity prediction | |
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14:50-15:00 |
Dr. Ashwani Sharma |
HepaRG™: an integrated model for studying bile canalicular functions and dysfunctions to understand Cholestasis toxicity. |
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15:00-15:10 |
Dr. Jayashree |
Synthesis and drug likeness evaluation of novel norfloxacin citrate conjugates as potential antibacterial and anticancer agents |
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15:20-15:30 |
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15:10-15:20 |
Exploring multiple binding pockets of drug targets as a new strategy for Anti-TB inhibitor design |
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15:30-16:30 |
Discussion |
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16:30-17:00 Tea break |
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17:00-17:30 |
Closing remarks and best poster prizes |
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19:00-20:30 Dinner |
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