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Past Events Archive

2023

2023 BioIT World Conference & Exposition
Hynes Convention Center, Boston, Massachusetts, USA
16th-18th May 2023

UK-QSAR Spring 2023 Meeting
Wellcome Genome Campus, Hinxton, Cambridgeshire
Thursday 20th April 2023

265th ACS National Meeting & Exposition
Indianapolis, Indiana, USA
26th-30th March 2023

2022

Cambridge Cheminformatics Network Meeting
Wednesday 30th November 2022

UK-QSAR Autumn 2022 Meeting
Francis Crick Institute, London
Tuesday 8th November 2022

11th RDKit User Group Meeting
Berlin, Germany
12th-14th October 2022

264th ACS National Meeting & Exposition
Chicago, IL, USA
21st-25th August 2022

RSC Symposium on Ultra-large Chemical Libraries
Burlington House, Piccadilly, London
10th August 2022

12th International Conference on Chemical Structures (ICCS)
Noordwijkerhout, The Netherlands
12th-16th June 2022

2022 BioIT World Conference & Exposition
Hynes Convention Center, Boston, Massachusetts, USA
3rd-5th May 2022

[Online] Open InChI Days 2022
5th-6th April 2022

263rd ACS National Meeting & Exposition
San Diego, CA, USA
20th-24th March 2022

2021

[Online] 10th RDKit User Group Meeting
14th-15th October 2021

[Online] 262nd ACS National Meeting & Exposition
Atlanta, GA, USA
22nd-26th August 2021

[Online] NIH Virtual Workshop on Reaction Informatics
18th-20th May 2021

[Online] 261st ACS National Meeting & Exposition
5th-16th April 2021

[Online] NIH Virtual Workshop on International Chemical Identifiers (InChI)
22nd-24th March 2021

2020

[Online] NIH Virtual Workshop on Ultra-Large Chemistry Databases
NIH NCI/NCATS, Washington DC, USA
1st-3rd December 2020

[Online] 9th RDKit User Group Meeting
Heimathafen Neukölln, Berlin, Germany
6th-8th October 2020

[Online] CLEF 2020 Conference and Labs of the Evaluation Forum
Centre for Research & Technology Hellas (CERTH), Thessaloniki, Greece
22nd-25th September 2020

[Online] Strasbourg Summer School in Cheminformatics 2020
University of Strasbourg, Strasbourg, France
29th June-3rd July 2020

[Online] Small Organic Molecules: Chemical Space, Reactions and Catalysis Workshop
Department of Statistics, University of Oxford, Oxford, UK
Tuesday 24th March 2020

AI for Reaction Outcome and Synthetic Route Prediction
DeVere Tortworth Court Hotel, Wotton-under-Edge, Bristol, UK
9th-11th March 2020

Cambridge Cheminformatics Network Meeting
Cambridge Crystallographic Data Centre (CCDC), Cambridge, UK
Wednesday 12th February 2020

2019

ELRIG Networking event: Artificial Intelligence in Drug Discovery
Alderley Park Conference Centre, Alderley Park, Macclesfield, UK
Thursday 5th December 2019

Oxford Comp Chem Kitchen (CCK-17)
Department of Biochemistry, University of Oxford, Oxford, UK
Thursday 28th November 2019

Cambridge Cheminformatics Network Meeting
Cambridge Crystallographic Data Centre (CCDC), Cambridge, UK
Wednesday 27th November 2019

Boston Area Group for Informatics and Modeling (BAGIM): Pat Walters
Relay Therapeutics, Cambridge, Massachusetts, USA
Monday 21st October 2019

What can Big Data do for Chemistry II
SCI Fine Chemical Group, SCI, Belgrave Square, London, UK
Wednesday 16th October 2019

Symposium to celebrate 10 years of the ChEMBL database
Welcome Genome Conference Centre, Hinxton, Cambridge, UK
Tuesday 8th October 2019

8th RDKit User Group Meeting
University of Hamburg, Hamburg, Germany
25th-27nd September 2019

Cambridge Cheminformatics Network Meeting
Chemistry Department, University of Cambridge, Cambridge, UK
Wednesday 4th September 2019

2nd RSC-BMCS/RSC-CICAG Artificial Intelligence in Chemistry
Fitzwilliam College, Cambridge, UK
2nd-3rd September 2019

258th ACS National Meeting & Exposition
San Diego, California, USA
25th-29th August 2019

Machine Learning and AI in (Bio)chemical Engineering
Department of Chemical Engineering and Biotechnology, University of Cambridge, Cambridge, UK
8th-9th July 2019

Cresset User Group Meeting 2019
The Møller Centre, Churchill College,Cambridge, UK
Thursday 20th June 2019

8th Joint Sheffield Conference on Chemoinformatics
The Edge, University of Sheffield, Sheffield, UK
17th-19th June 2019

Cambridge Cheminformatics Network Meeting
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
Wednesday 15th May 2019

2019 BioIT World Conference & Exposition
Seaport World Trade Center, Boston, Massachusetts, USA
16th-18th April 2019

Big Ideas for Big Data in Drug Discovery
School of Pharmacy, University College London (UCL), London, UK
Friday 12th April 2019

Spring 2019 UKQSAR Meeting
Howard Theatre, Downing College, Cambridge, UK
Thursday 4th April 2019

257th ACS National Meeting & Exposition
Orlando, Florida, USA
31st March-4th April 2019

ACS COMP Together San Franciso February 2019
Genentech Hall, UCSF, San Francisco, California, USA
Tuesday 19th February 2019

Cambridge Cheminformatics Network Meeting
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
Wednesday 13th February 2019

IUPAC InChI Workshop 2019
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
4th-5th February 2019

2018

Cambridge Cheminformatics Network Meeting
Cambridge Crystallographic Data Centre (CCDC), Cambridge, UK
Wednesday 28th November 2018

Autumn 2018 UKQSAR Meeting
Lady Margaret Hall Conference Centre, Oxford University, Oxford, UK
Wednesday 26th September 2018

7th RDKit User Group Meeting
Chemistry Department, University of Cambridge, Cambridge, UK
19th-21nd September 2018

Cambridge Cheminformatics Network Meeting
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
Wednesday 5th September 2018

256th ACS National Meeting & Exposition
Boston, Massachusetts, USA
19th-23th August 2018

RSC-BMCS/RSC-CICAG Artificial Intelligence in Chemistry
Royal Society of Chemistry, Burlington House, London, UK
Friday 15th June 2018

Dotmatics Symposium UK 2018
Wellcome Genome Campus Conference Centre, Hinxton, UK
14th-15th June 2018

11th International Conference on Chemical Structures (ICCS)
Noordwijkerhout, The Netherlands
27th-31st May 2018

2018 BioIT World Conference & Exposition
Seaport World Trade Center, Boston, Massachusetts
15rd-17th May 2018

255th ACS National Meeting & Exposition
New Orleans, Louisiana, USA
18th-22nd March 2018

EBI Industry Workshop: AI-Assisted Knowledge Acquisition for Biomedical Researchers
European Bioinformatics Institue (EBI), Hinxton, Cambridgeshire, UK
7th-8th March 2018

Cambridge Cheminformatics Network Meeting
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
Wednesday 14th February 2018

2017

Cambridge Cheminformatics Network Meeting
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
Wednesday 29th November 2017

SCI: What can Big Data do for Chemistry?
SCI, Belgrave Square, London, UK
Wednesday 11th October 2017

6th RDKit User Group Meeting
Dahlem Campus, Freie University Berlin, Berlin, Germany
20th-22nd September 2017

Cambridge Cheminformatics Network Meeting
Cambridge Crystallographic Data Centre (CCDC), Cambridge, UK
Wednesday 6th September 2017

254th ACS National Meeting & Exposition
Washington DC, USA
20th-24th August 2017

Status and Future of the IUPAC InChI: Context and Use Cases
NIH Campus, Bethesda, Maryland, USA
16th-18th August 2017

2017 BioIT World Conference & Exposition
Seaport World Trade Center, Boston, Massachusetts
23rd-25th May 2017

Spring 2017 UKQSAR Meeting
Syngenta, Jealott's Hill, Berkshire, UK
Wednesday 26th April 2017

253rd ACS National Meeting & Exposition
San Francisco, California
2nd-6th April 2017

Cambridge Cheminformatics Network Meeting
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
24th May 2017

Cambridge Cheminformatics Network Meeting
Cambridge Crystallographic Data Centre (CCDC), Cambridge, UK
15th February 2017

2016

Cambridge Cheminformatics Network Meeting
European Bioinformatics Institue (EBI), Hinxton, Cambridgeshire, UK
7th December 2016

5th RDKit User Group Meeting
Novartis, Basel, Switzerland
26th-28th October 2016

UK QSAR Autumn 2016 Meeting
The Institute of Cancer Research (ICR), Sutton, UK
Wednesday 19th October 2016

Cambridge Cheminformatics Network Meeting
Centre for Molecular Informatics, Chemistry Department, Cambridge, UK
31st August 2016

252nd ACS National Meeting & Exposition
Philadelphia, Pennsylvania, USA
21st-25th August 2016

7th Joint Sheffield Conference on Chemoinformatics
The Edge, University of Sheffield, Sheffield, UK
4th-6th July 2016

2016 BioIT World Conference & Exposition
Seaport World Trade Center, Boston, Massachusetts, USA
5th-7th April 2016

UK QSAR Spring 2016
GlaxoSmithKline, Stevenage, UK
15th-16th March 2016

251st ACS National Meeting & Exposition
San Diego, California, USA
13th-17th March 2016

Cambridge Cheminformatics Network Meeting
Cambridge Crystallographic Data Centre (CCDC), Cambridge, UK
17th February 2016

2015

UK QSAR Autumn 2015
Duxford, Cambridgeshire, UK
6th October 2015

BioCreative V Challenge and Workshop
Sevilla, Spain
9th-11th September 2015

4th RDKit User Group Meeting
ETH, Zurich, Switzerland
2nd-4th September 2015

250th ACS National Meeting & Exposition
Boston, Massachusetts, USA
16th-20th August 2015

RSC Meeting: From Big Data to Chemical Information
RSC, Burlington House, London, UK
22nd April 2015

2015 BioIT World Conference & Exposition
Seaport World Trade Center, Boston, Massachusetts, USA
21st-23rd April 2015

249th ACS National Meeting & Exposition
Denver, Colorado, USA
22nd-26th March 2015

Cambridge Cheminformatics Network Meeting
CCDC, Cambridge, UK
25th February 2015

2014

MGMS Young Modellers' Forum 2014
School of Oriental and African Studies, London, UK
28th November 2014

InChI for Large Molecules
NCBI, Lister Hill Center, Bethesda, MD, USA
27th-28th October 2014

3rd RDKit User Group Meeting
Merck KGaA, Darmstadt, Germany
22nd-24th October 2014

Royal Society of Chemistry CICAG: What's in a Name?
RSC Library, Burlington House, Piccadilly, London, UK
21st October 2014

UK QSAR Autumn 2014
Cambridge Crystallographic Data Centre (CCDC), Cambridge, UK
30th September 2014

Discuva: One Bug, One Drug Conference
Peterhouse College, Cambridge, UK
24th September 2014

Dotmatics European User Group Meeting 2014
Down Hall Country House Hotel, Hertfordshire, UK
15th-16th September 2014

Dial-a-Molecule: Computational Prediction of Reaction Outcomes and Optimum Synthetic Routes
Westwood Hall Conference Centre & Hotel, Leeds, UK
10th-11th September 2014

Cambridge Cheminformatics Network Meeting
Unilever Centre, Cambridge, UK
27th August 2014

248th ACS National Meeting & Exposition
San Francisco, California, USA
10th-14th August 2014

Defining the Future for Open Notebook Science – A Memorial Symposium Celebrating the Work of Jean-Claude Bradley
Chemistry Department, University of Cambridge, UK
14th July 2014

10th International Conference on Chemical Structures and 10th German Conference on Chemoinformatics
Noordwijkerhout, The Netherlands
1st-5th June 2014

Cambridge Cheminformatics Network Meeting
Unilever Centre, Cambridge, UK
28th May 2014

ChemAxon User Group Meeting (UGM) Budapest 2014
Hotel Novotel Budapest Centrum, Budapest, Hungary
20th-21st May 2014

2013

25th International Conference for the Information Community (ICIC) 2013
Hotel Savoyen, Vienna, Austria
13th-16th October 2013

2nd RDKit User Group Meeting
EBI, Hinxton, Cambridgeshire, UK
2nd-4th October 2013

ChemAxon US User Group Meeting San Diego 2013
Catamaran Resort Hotel & Spa, San Diego, California, USA
23rd-25th September 2013

Dotmatics European User Group Meeting 2013
Down Hall Country House Hotel, Hertfordshire, UK
16th-17th September 2013

246th ACS National Meeting & Exposition
Indianapolis, Indiana, USA
8th-12th September 2013

IUPAC 2013: 47th General Assembly
Istanbul, Turkey
8th-15th August 2013

6th Joint Sheffield Conference on Chemoinformatics
The Edge, University of Sheffield, Sheffield, UK
22nd-24th July 2013

ChemAxon User Group Meeting Budapest 2013
Hotel Novotel Budapest Centrum, Budapest, Hungary
28th-29th May 2013

OpenEye EuroCUP VI
Duin & Kruidberg Hotel, Santpoort, The Netherlands
15th-17th May 2013

245th ACS National Meeting & Exposition
New Orleans, Louisiana, USA
7th-11th April 2013

2012

UK QSAR Autumn 2012 Meeting
Downing College, Cambridge, UK
Thursday 8th November 2012

1st RDKit User Group Meeting
The Institute of Cancer Research, London, UK
3rd-4th October 2012

2011

9th International Conference on Chemical Structures (ICCS)
Noordwijkerhout, The Netherlands
5th-9th June 2011

2010

6th German Conference on Cheminformatics (GCC)
Goslar, Germany
7th-9th November 2010

Arthor provides fast state-of-the-art substructure and chemical similarity search capabilities for ultra-large databases of hundreds of millions of compounds, using SMARTS optimization, Just-In-Time compilation and/or GPUs.
CaffeineFix is used to rapidly match chemical names or terms against a dictionary or grammar (e.g. a grammar for IUPAC names). As well as use in text-mining, it can be used to provide autocomplete functionality and spell-correction.
Casandra is a server for delivering real time safety warnings of experimental hazards straight to the pharmaceutical electronic laboratory notebooks (ELNs).

HazELNut is a suite of tools used to extract, normalize and analyse information in Electronic Lab Notebooks (ELNs). This can be used to implement a search interface, find/eliminate duplicates, find similar reactions and so on.
LeadMine extracts chemical names and terms from text. It incorporates NextMove's CaffeineFix technology to find terms that match appropriate dictionaries or grammars. It has enhanced functionality to handle the patent literature.
Matsy is a set of tools for creating and analysing Matched Molecular Series (the general form of Matched Molecular Pairs). In particular, it can be used to suggest what compound to make next in a Medicinal Chemistry program.
MPSearch rapidly searches a database to find Matched Pairs related to a query molecule. This type of search is used to explore previous medicinal chemistry strategies.
NameRXN is used to classify and name reactions. It is particular useful in the context of ELN analysis but also as a plugin to chemical drawing software. NameRXN builds on NextMove Software's Patsy technology.
Patsy is used to speed up SMARTS pattern matching by creating optimized SMARTS patterns or source code. Speed gains are particularly large when multiple SMARTS patterns are matched against a single structure.
Pistachio is a reaction dataset browser providing loading, querying, and analytics of chemical reactions. With over 9 million chemical reactions extracted from US & EPO patents, it demonstrates an AI interface to faceted (structure) search
SmallWorld is an index of chemical space based on more than 230 billion molecular substructures. It can be used to measure similarity based on graph-edit distance, find the MCS of two or more molecules, analyse HTS results and much more.
Sugar & Splice can be used to perceive and depict biopolymer structure. It makes it easy to interconvert between small-molecule representations (e.g. SMILES, MOL) and biopolymer representations (HELM, IUPAC line notation).
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