BEGIN:VCALENDAR
VERSION:2.0
PRODID:-//CCP5//CCP5 AGM 2026 Timetable//EN
CALSCALE:GREGORIAN
METHOD:PUBLISH
X-WR-CALDESC:46th CCP5 Annual General Meeting and Conference 2026 - Univer
 sity of Edinburgh
X-WR-CALNAME:CCP5 AGM 2026
X-WR-TIMEZONE:Europe/London
BEGIN:VTIMEZONE
TZID:Europe/London
BEGIN:STANDARD
DTSTART:19961027T020000
RRULE:FREQ=YEARLY;BYDAY=-1SU;BYMONTH=10
TZNAME:GMT
TZOFFSETFROM:+0100
TZOFFSETTO:+0000
END:STANDARD
BEGIN:DAYLIGHT
DTSTART:19810329T010000
RRULE:FREQ=YEARLY;BYDAY=-1SU;BYMONTH=3
TZNAME:BST
TZOFFSETFROM:+0000
TZOFFSETTO:+0100
END:DAYLIGHT
END:VTIMEZONE
BEGIN:VEVENT
SUMMARY:Arrival\, Registration & Lunch
DTSTART;TZID=Europe/London:20260909T120000
DTEND;TZID=Europe/London:20260909T130000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-01-arrival-lunch@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Registration,Lunch,Meal
CLASS:PUBLIC
COLOR:#059669
DESCRIPTION:Arrival\, Registration & Lunch - CCP5 AGM 2026\nVenue: Nucleus
  Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#059669
X-COLOR:#059669
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Welcome and Introduction
DTSTART;TZID=Europe/London:20260909T130000
DTEND;TZID=Europe/London:20260909T131500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-02-welcome@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:General Session
CLASS:PUBLIC
COLOR:#4B5563
DESCRIPTION:Welcome and Introduction - CCP5 AGM 2026\nVenue: 2.07 - Yew Le
 cture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#4B5563
X-COLOR:#4B5563
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:[Invited Talk] Prof David Wales - Energy landscapes: Exploration a
 nd Discovery
DTSTART;TZID=Europe/London:20260909T131500
DTEND;TZID=Europe/London:20260909T140000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-03-wales@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Invited Talk
CLASS:PUBLIC
COLOR:#DC2626
DESCRIPTION:Speaker: Prof David Wales (University of Cambridge)\nTitle: En
 ergy landscapes: Exploration and Discovery\nVenue: 2.07 - Yew Lecture Thea
 tre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#DC2626
X-COLOR:#DC2626
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Peter Cummings - Achieving Reproducibility and Replicability of Mo
 lecular Dynamics and Monte Carlo Simulations Using the Molecular Simulatio
 n Design Framework (MoSDeF)
DTSTART;TZID=Europe/London:20260909T140000
DTEND;TZID=Europe/London:20260909T142000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-04-cummings@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Peter Cummings (Heriot-Watt University)\nTitle: Achie
 ving Reproducibility and Replicability of Molecular Dynamics and Monte Car
 lo Simulations Using the Molecular Simulation Design Framework (MoSDeF)\nV
 enue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Nasser Afify - Multiscale Atomistic Simulation of Energy Materials
  and Processes — Limitations and Opportunities
DTSTART;TZID=Europe/London:20260909T142000
DTEND;TZID=Europe/London:20260909T144000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-05-afify@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Nasser Afify (University of Edinburgh)\nTitle: Multis
 cale Atomistic Simulation of Energy Materials and Processes — Limitation
 s and Opportunities\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Elliott Kasoar - ML-PEG: ML Performance and Extrapolation Guide
DTSTART;TZID=Europe/London:20260909T144000
DTEND;TZID=Europe/London:20260909T150000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-06-kasoar@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Elliott Kasoar (STFC/University of Cambridge)\nTitle:
  ML-PEG: ML Performance and Extrapolation Guide\nVenue: 2.07 - Yew Lecture
  Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Coffee Break
DTSTART;TZID=Europe/London:20260909T150000
DTEND;TZID=Europe/London:20260909T153000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-07-coffee@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Break
CLASS:PUBLIC
COLOR:#059669
DESCRIPTION:Coffee Break and Refreshments\nVenue: Nucleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#059669
X-COLOR:#059669
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:[Invited Talk] Prof Maria Grazia De Angelis - Bridging AI and Phys
 ics-Based Models for Predicting Material Separation Performance
DTSTART;TZID=Europe/London:20260909T153000
DTEND;TZID=Europe/London:20260909T161500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-08-deangelis@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Invited Talk
CLASS:PUBLIC
COLOR:#DC2626
DESCRIPTION:Speaker: Prof Maria Grazia De Angelis (University of Bologna)
 \nTitle: Bridging AI and Physics-Based Models for Predicting Material Sepa
 ration Performance\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#DC2626
X-COLOR:#DC2626
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Leo Lue - A gradient density functional theory for self-assembling
  molecular systems
DTSTART;TZID=Europe/London:20260909T161500
DTEND;TZID=Europe/London:20260909T163500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-09-lue@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Leo Lue (University of Strathclyde)\nTitle: A gradien
 t density functional theory for self-assembling molecular systems\nVenue: 
 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Lois Smith - PolyRapid: Automated High-Throughput Screening of Pol
 ymers Using a Computational Workflow
DTSTART;TZID=Europe/London:20260909T163500
DTEND;TZID=Europe/London:20260909T165500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-10-smith@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Lois Smith (University of Liverpool)\nTitle: PolyRapi
 d: Automated High-Throughput Screening of Polymers Using a Computational W
 orkflow\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Poster Session
DTSTART;TZID=Europe/London:20260909T165500
DTEND;TZID=Europe/London:20260909T183000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d1-11-posters@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Poster Session
CLASS:PUBLIC
COLOR:#7C3AED
DESCRIPTION:Poster Session - CCP5 AGM 2026\nVenue: Nucleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#7C3AED
X-COLOR:#7C3AED
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:[Invited Talk] Prof Ed Maginn - Thermal Conductivity of Ionic Liqu
 id Mixtures: From Nanostructure to Accurate Molecular Simulation
DTSTART;TZID=Europe/London:20260910T090000
DTEND;TZID=Europe/London:20260910T094500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-01-maginn@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Invited Talk
CLASS:PUBLIC
COLOR:#DC2626
DESCRIPTION:Speaker: Prof Ed Maginn (University of Notre Dame)\nTitle: The
 rmal Conductivity of Ionic Liquid Mixtures: From Nanostructure to Accurate
  Molecular Simulation\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#DC2626
X-COLOR:#DC2626
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Mazin Saad Almarashi - Using molecular simulations to examine the 
 interaction of permeation enhancers with the skin barrier
DTSTART;TZID=Europe/London:20260910T094500
DTEND;TZID=Europe/London:20260910T100500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-02-almarashi@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Mazin Saad Almarashi (Heriot-Watt University)\nTitle:
  Using molecular simulations to examine the interaction of permeation enha
 ncers with the skin barrier\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Stephen Yeandel - Computational Insights into Phase Stability and 
 Surface Segregation in GLO
DTSTART;TZID=Europe/London:20260910T100500
DTEND;TZID=Europe/London:20260910T102500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-03-yeandel@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Stephen Yeandel (University of Bristol)\nTitle: Compu
 tational Insights into Phase Stability and Surface Segregation in GLO\nVen
 ue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Rhys Blaney - Quantifying Force Field Uncertainty for Biogas Upgra
 ding in Zeolites
DTSTART;TZID=Europe/London:20260910T102500
DTEND;TZID=Europe/London:20260910T104500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-04-blaney@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Rhys Blaney (The University of Strathclyde)\nTitle: Q
 uantifying Force Field Uncertainty for Biogas Upgrading in Zeolites\nVenue
 : 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Coffee Break
DTSTART;TZID=Europe/London:20260910T104500
DTEND;TZID=Europe/London:20260910T111500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-05-coffee@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Break
CLASS:PUBLIC
COLOR:#059669
DESCRIPTION:Coffee Break and Refreshments\nVenue: Nucleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#059669
X-COLOR:#059669
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Panagiotis Kourtis - Applications of MACE Foundational Models on B
 attery Electrolytes
DTSTART;TZID=Europe/London:20260910T111500
DTEND;TZID=Europe/London:20260910T113500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-06-kourtis@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Panagiotis Kourtis (Newcastle University)\nTitle: App
 lications of MACE Foundational Models on Battery Electrolytes\nVenue: 2.07
  - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Marco Mattia - Learning kinase conformation across activation
DTSTART;TZID=Europe/London:20260910T113500
DTEND;TZID=Europe/London:20260910T115500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-07-mattia@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Marco Mattia (University of Edinburgh)\nTitle: Learni
 ng kinase conformation across activation\nVenue: 2.07 - Yew Lecture Theatr
 e
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Sarah Stewart - Amino Acid–Clay Interactions on Mars-Relevant Mi
 nerals
DTSTART;TZID=Europe/London:20260910T115500
DTEND;TZID=Europe/London:20260910T121500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-08-stewart@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Sarah Stewart (University of Edinburgh)\nTitle: Amino
  Acid–Clay Interactions on Mars-Relevant Minerals\nVenue: 2.07 - Yew Lec
 ture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Stepan Zhikharev - chirality-kit: A stand-alone topology generator
  for functionalised and solvated nanostructures.
DTSTART;TZID=Europe/London:20260910T121500
DTEND;TZID=Europe/London:20260910T123500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-09-zhikharev@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Stepan Zhikharev (University of Warwick)\nTitle: chir
 ality-kit: A stand-alone topology generator for functionalised and solvate
 d nanostructures.\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Lunch
DTSTART;TZID=Europe/London:20260910T123500
DTEND;TZID=Europe/London:20260910T133500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-10-lunch@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Lunch,Meal
CLASS:PUBLIC
COLOR:#059669
DESCRIPTION:Lunch Break - CCP5 AGM 2026\nVenue: Nucleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#059669
X-COLOR:#059669
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:[Invited Talk] Dr James Ewen - Molecular Simulations of Interfacia
 l Processes
DTSTART;TZID=Europe/London:20260910T133500
DTEND;TZID=Europe/London:20260910T142000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-11-ewen@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Invited Talk
CLASS:PUBLIC
COLOR:#DC2626
DESCRIPTION:Speaker: Dr James Ewen (University of Bath)\nTitle: Molecular 
 Simulations of Interfacial Processes\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#DC2626
X-COLOR:#DC2626
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Michael Seaton - Polarising highly coarse-grained water for aqueou
 s electrolytes
DTSTART;TZID=Europe/London:20260910T142000
DTEND;TZID=Europe/London:20260910T144000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-12-seaton@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Michael Seaton (UKRI STFC Daresbury Laboratory)\nTitl
 e: Polarising highly coarse-grained water for aqueous electrolytes\nVenue:
  2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Miguel Jorge - Quantifying uncertainty in experimental and simulat
 ed adsorption in Metal-Organic Frameworks
DTSTART;TZID=Europe/London:20260910T144000
DTEND;TZID=Europe/London:20260910T150000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-13-jorge@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Miguel Jorge (University of Strathclyde)\nTitle: Quan
 tifying uncertainty in experimental and simulated adsorption in Metal-Orga
 nic Frameworks\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Asal Azar - Allosteric Regulation of Nitrite Reductase AniA Trimer
 isation by Copper Binding
DTSTART;TZID=Europe/London:20260910T150000
DTEND;TZID=Europe/London:20260910T152000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-14-azar@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Asal Azar (University of Edinburgh)\nTitle: Allosteri
 c Regulation of Nitrite Reductase AniA Trimerisation by Copper Binding\nVe
 nue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Coffee Break
DTSTART;TZID=Europe/London:20260910T152000
DTEND;TZID=Europe/London:20260910T155000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-15-coffee@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Break
CLASS:PUBLIC
COLOR:#059669
DESCRIPTION:Coffee Break and Refreshments\nVenue: Nucleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#059669
X-COLOR:#059669
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Karen Johnston - A Molecular Dynamics Seeding Approach to Determin
 e Critical Nucleus Size and Concentration for Crystal Nucleation
DTSTART;TZID=Europe/London:20260910T155000
DTEND;TZID=Europe/London:20260910T161000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-16-johnston@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Karen Johnston (University of Strathclyde)\nTitle: A 
 Molecular Dynamics Seeding Approach to Determine Critical Nucleus Size and
  Concentration for Crystal Nucleation\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Amro Mohamed - Computational Screening of Lignin-Derived Epoxy Net
 works for Gas Separation
DTSTART;TZID=Europe/London:20260910T161000
DTEND;TZID=Europe/London:20260910T163000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-17-mohamed@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Amro Mohamed (Heriot-Watt University)\nTitle: Computa
 tional Screening of Lignin-Derived Epoxy Networks for Gas Separation\nVenu
 e: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Jasmine Lightfoot - From atoms to application: scalable simulation
 -driven formulation design
DTSTART;TZID=Europe/London:20260910T163000
DTEND;TZID=Europe/London:20260910T165000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-18-lightfoot@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Jasmine Lightfoot (STFC Hartree Centre)\nTitle: From 
 atoms to application: scalable simulation-driven formulation design\nVenue
 : 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Joseph Thomas - Uncovering Ion Transport Pathways in High-Temperat
 ure Green Hydrogen Electrolyser Membranes via Machine-Learned Interatomic 
 Potentials
DTSTART;TZID=Europe/London:20260910T165000
DTEND;TZID=Europe/London:20260910T171000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-19-thomas@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Joseph Thomas (Northumbria University)\nTitle: Uncove
 ring Ion Transport Pathways in High-Temperature Green Hydrogen Electrolyse
 r Membranes via Machine-Learned Interatomic Potentials\nVenue: 2.07 - Yew 
 Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Vanessa Ward - Understanding Correlated Motion is Critical to Accu
 rate Predictions of Ionic Conductivity
DTSTART;TZID=Europe/London:20260910T171000
DTEND;TZID=Europe/London:20260910T173000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-20-ward@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Vanessa Ward (Durham University)\nTitle: Understandin
 g Correlated Motion is Critical to Accurate Predictions of Ionic Conductiv
 ity\nVenue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Conference Dinner - Hotel du Vin
DTSTART;TZID=Europe/London:20260910T190000
DTEND;TZID=Europe/London:20260910T220000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d2-21-dinner@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Dinner,Social
CLASS:PUBLIC
COLOR:#9333EA
DESCRIPTION:Conference Dinner - CCP5 AGM 2026\nVenue: Hotel du Vin\nAddres
 s: 11 Bristo Place\, Edinburgh\, EH1 1EZ
LOCATION:Hotel du Vin\, 11 Bristo Place\, Edinburgh\, EH1 1EZ
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#9333EA
X-COLOR:#9333EA
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:[Invited Talk] Prof Tell Tuttle - Peptides at the Edge: Designing 
 Function at Mineral and Ice Interfaces
DTSTART;TZID=Europe/London:20260911T090000
DTEND;TZID=Europe/London:20260911T094500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-01-tuttle@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Invited Talk
CLASS:PUBLIC
COLOR:#DC2626
DESCRIPTION:Speaker: Prof Tell Tuttle (University of Strathclyde)\nTitle: 
 Peptides at the Edge: Designing Function at Mineral and Ice Interfaces\nVe
 nue: 2.07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#DC2626
X-COLOR:#DC2626
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Umberto Terranova - Iron–Sulfur Cluster Redox Potentials Across 
 Biological Scales
DTSTART;TZID=Europe/London:20260911T094500
DTEND;TZID=Europe/London:20260911T100500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-02-terranova@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Umberto Terranova (University of Buckingham)\nTitle: 
 Iron–Sulfur Cluster Redox Potentials Across Biological Scales\nVenue: 2.
 07 - Yew Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Duncan Dockar - Are bulk nanobubbles stabilised by contaminant sur
 factants?
DTSTART;TZID=Europe/London:20260911T100500
DTEND;TZID=Europe/London:20260911T102500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-03-dockar@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Duncan Dockar (University of Edinburgh)\nTitle: Are b
 ulk nanobubbles stabilised by contaminant surfactants?\nVenue: 2.07 - Yew 
 Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Werner Muller - Developing a Novel Coarse-Grained Force Field for 
 Polyvinyl Chloride: Viscosity Predictions and Uncertainty Quantification
DTSTART;TZID=Europe/London:20260911T102500
DTEND;TZID=Europe/London:20260911T104500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-04-muller@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Werner Muller (IFP Energies nouvelles)\nTitle: Develo
 ping a Novel Coarse-Grained Force Field for Polyvinyl Chloride: Viscosity 
 Predictions and Uncertainty Quantification\nVenue: 2.07 - Yew Lecture Thea
 tre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Coffee Break
DTSTART;TZID=Europe/London:20260911T104500
DTEND;TZID=Europe/London:20260911T111500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-05-coffee@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Break
CLASS:PUBLIC
COLOR:#059669
DESCRIPTION:Coffee Break and Refreshments\nVenue: Nucleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#059669
X-COLOR:#059669
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Andrew Logsdail - Developing new catalysts for CO2 hydrogenation t
 o fuels through multiscale computational modelling
DTSTART;TZID=Europe/London:20260911T111500
DTEND;TZID=Europe/London:20260911T113500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-06-logsdail@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Andrew Logsdail (Cardiff Catalysis Institute\, Cardif
 f University)\nTitle: Developing new catalysts for CO2 hydrogenation to fu
 els through multiscale computational modelling\nVenue: 2.07 - Yew Lecture 
 Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Joseph Burke - Coarse-grained modelling of porous materials discov
 ery
DTSTART;TZID=Europe/London:20260911T113500
DTEND;TZID=Europe/London:20260911T115500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-07-burke@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Joseph Burke (Imperial College London)\nTitle: Coarse
 -grained modelling of porous materials discovery\nVenue: 2.07 - Yew Lectur
 e Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Andreas Hermann - Atomistic modelling challenges for metal superhy
 drides
DTSTART;TZID=Europe/London:20260911T115500
DTEND;TZID=Europe/London:20260911T121500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-08-hermann@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Andreas Hermann (The University of Edinburgh)\nTitle:
  Atomistic modelling challenges for metal superhydrides\nVenue: 2.07 - Yew
  Lecture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Shubham Deshpande - Investigating the effects of ceramide variatio
 n on lipid organisation in the stratum corneum from molecular dynamics sim
 ulations
DTSTART;TZID=Europe/London:20260911T121500
DTEND;TZID=Europe/London:20260911T123500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-09-deshpande@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Contributed Talk
CLASS:PUBLIC
COLOR:#2563EB
DESCRIPTION:Speaker: Shubham Deshpande (Heriot-Watt University)\nTitle: In
 vestigating the effects of ceramide variation on lipid organisation in the
  stratum corneum from molecular dynamics simulations\nVenue: 2.07 - Yew Le
 cture Theatre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#2563EB
X-COLOR:#2563EB
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Closing Remarks
DTSTART;TZID=Europe/London:20260911T123500
DTEND;TZID=Europe/London:20260911T124500
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-10-closing@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:General Session
CLASS:PUBLIC
COLOR:#4B5563
DESCRIPTION:Closing Remarks - CCP5 AGM 2026\nVenue: 2.07 - Yew Lecture The
 atre
LOCATION:2.07 - Yew Lecture Theatre\, 2nd Floor\, Nucleus Building\, King'
 s Buildings campus\, University of Edinburgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#4B5563
X-COLOR:#4B5563
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Lunch and Departure
DTSTART;TZID=Europe/London:20260911T124500
DTEND;TZID=Europe/London:20260911T140000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-11-lunch@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Lunch,Meal
CLASS:PUBLIC
COLOR:#059669
DESCRIPTION:Lunch and Departure - CCP5 AGM 2026\nVenue: Nucleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#059669
X-COLOR:#059669
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
BEGIN:VEVENT
SUMMARY:Parallel Session: CCP5 Executive Committee Meeting
DTSTART;TZID=Europe/London:20260911T124500
DTEND;TZID=Europe/London:20260911T140000
DTSTAMP:20260906T190241Z
UID:ccp5-agm2026-d3-12-exec-committee@ccp5.ac.uk
SEQUENCE:0
CATEGORIES:Meeting,Committee
CLASS:PUBLIC
COLOR:#D97706
DESCRIPTION:CCP5 Executive Committee Meeting (Parallel Session)\nVenue: Nu
 cleus Building
LOCATION:Nucleus Building\, King's Buildings campus\, University of Edinbu
 rgh
STATUS:CONFIRMED
TRANSP:OPAQUE
X-APPLE-CALENDAR-COLOR:#D97706
X-COLOR:#D97706
X-MICROSOFT-CDO-BUSYSTATUS:BUSY
END:VEVENT
END:VCALENDAR