Australian National UniversityQuantum Chemistry at ANU

Computational Chemistry Group Meetings

Date Speaker Caterer Title
25 DecChristmas Day
18 DecAlexKarmenTBA
11 DecKarmenPickleMDbox (May Data Be On eXquisite) Repository
04 DecVladRikaAmber, Gaussian, and molecular dynamics of ferrocene
27 NovRikaJoshHPC trends in computational chemistry
20 NovJoshPickleVariationally enhanced sampling
13 NovPickleHugoBloberator
06 NovHonours Panel meetings
30 OctRoLi HuMiDoSimonHonours practice talks
23 OctCHEM ASC seminars
16 OctCHEM 3060 seminars
09 OctNo group meeting
02 OctLabour Day
25 SepFamily and Community Day
18 SepSimonAdamSquare peg in a round hole: The correct correlation shape factor
11 SepNo group meeting
04 SepWATOC 2017 Congress
28 AugWATOC 2017 Congress
21 AugWATOC 2017 Congress
14 AugAdamMichelleThe problems facing artificial intelligence in chemistry
07 AugNo group meeting
31 JulyLijuanHugoComputational insights for the hydride transfer and distinctive roles of key residues in cholesterol oxidase
24 JulyNo group meeting
17 JulyHugoMahakaranMetal-ion modelling in classical mechanics
10 JulyNo group meeting
03 JulyMahakaranJoshInvestigating Kemp eliminase activity using molecular dynamics simulation
26 JunJoshEllenMulti-scale modelling
20 JunEllenGiuseppeDevelopment and application of statistical and quantum mechanical methods for modelling molecular ensembles
14 JunGiuseppeJing(end of term) Single-determinant models for electronic excited states
12 JunQueen's Birthday
05 JunJingMitchHonours practice talk
29 MayNo group meeting
22 MayZhipeng/MitchMichelleASC projects
15 MayMichelleMickChallenges for modelling electrostatic catalysis
08 MayNo group meeting
01 MayMickJoshTalking about talking
26 AprJoshAlex(mid-term) From force field to PES dispenser: in silico biomolecular modelling
24 AprAnzac Day
17 AprEaster Monday
10 AprAlexDoug(mid-term) The effect of bilayer composition on membrane/protein interactions
03 AprAdam, Jason, Alfred, DougSimonHonours practice talks
27 MarSimonAmandaFull of pseudopotential
20 MarAmandaNaomiComfortably numb: Determining binding behaviour of local anaesthetics using MD simulations
14 MarNaomiGillesDisulfides in action - exploring protein switching
13 MarCanberra Day
06 MarNo group meeting
27 FebGillesRikaAb initio based kinetic modelling to unravel complex reaction mechanisms in polymer chemistry
20 FebRikaFragmentation methods for diverse chemical properties
13 FebNo group meeting
06 FebNo group meeting
30 JanNo group meeting
23 JanNo group meeting
16 JanNo group meeting
09 JanNo group meeting
02 JanNew Year's Day