RUB » AC I » SMI Symposium

Scientific program

March 25, 2012

Time Event
18.00-20.00 Come Together

March 26, 2012

Time Speaker/ Event Title
From 8.00 Registration
09.45-10.00 Opening of Symposium
10.00-10.30 Gautam R. Desiraju Halogen bonding in crystal engineering
10.30-11.00 Andrzej Katrusiak Intermolecular interactions in compressed crystals
11.00-11.30 Oleg V. Shishkin Supramolecular architecture of molecular crystals derived from topology of intermolecular interactions
11.30-12.00 Oral Poster Presentations
12.00-13.00 Lunch
13.00-13.30 Angshuman R.Choudhury Study of weak interactions in halogen substituted diphenylmethanimine and diphenyldiazenes
13.30-14.00 T. N. Guru Row Charge density analysis of intermolecular interactions from supramolecular synthons
14.00-14.30 Vera Vasylyeva Influence of weak directing substituents on molecular aggregation
14.30-15.00 Dmitry Yufit Low-melting molecular complexes of methyl halides – halogen bonding makes the difference
15.00-16.00 Coffee break & Poster Session
16.00-16.30 Christof Hättig Explicitly-correlated wavefunction methods: New perspectives for ab initio studies on intermolecular interactions
16.30-17.00 George Pitsevich The argon matrix affects on internal rotation barriers and torsional states of CH3OH
17.00-17.30 Valeriy Pogorelov H-bond clustering of small molecules isolated in low temperature argon matrix
17.30-18.30 Poster Session
19.00- Conference Dinner

March 27, 2012

Time Speaker/ Event Title
9.00-9.30 Roland Boese Supramolecular synthesis – co-crystallization of small molecules
9.30-10.00 Christian Lehmann Preparation and structure determination of diastereomeric co-crystals
10.00-10.30 V. R. Pedireddi Molecular recognition studies of cyanuric and trithiocyanuric acids
10.30-11.00 Coffee break
11.00-11.30 Agata Bialonska Solid solutions of brucinium diastereomeric salts with N-(3-nitrobenzoyl)- amino acid
11.30-12.00 Michael Mastalerz Defined organic molecules for permanent porous crystals
12.00-12.30 Andrew D. Bond Rediscovering polytypism in molecular crystals
12.30-13.30 Lunch
13.30-16.00 Exhibitions Bergbaumuseum Bochum OR Botanischer Garten (RUB)
16.00-16.30 Rochus Schmid Towards first principles derived force fields for host-guest interactions in porous hybrid materials
16.30-17.00 Detlef W. M. Hofmann Fast estimation of the free energy of synthons by data mining
17.00-17.30 Tatiana E. Gorelik Electron diffraction on molecular crystals
17.30-17.45 Closing of Symposium