Blog

Science

How computational chemistry tools can help drug repurposing?

For most of the past decade, the number of drugs approved every

July 31, 2018 No Comments

Fragment Based Drug Design and Field-Based Technology

Image obtained from Advances in Fragment-Based Drug Discovery by Laura Elizabeth Mason

July 9, 2018 No Comments

PharmScreen GUI v2.0 released: faster and easier! Request a demo

We have been working hard to bring up a new Graphical User

May 15, 2018 No Comments

Publications

HPC opportunities in Europe for Life Sciences

High-Performance Computing (HPC) has become a priority in Europe and it is

March 21, 2018 No Comments

Publications

What is Eroom’s Law?

Despite the large number of advances in the scientific and technical field

March 8, 2018 No Comments

Publications

Are you considering tautomerism, ionization and chirality when identifying new hits?

Tautomerism, ionization and chirality are important factors to consider when building a compound

January 17, 2018 No Comments

News

Bosch i Gimpera Foundation Award

Professor Javier Luque (h-index of 66), Pharmacelera’s Scientific Director, has received the

December 15, 2017 No Comments

Science

Alignment of PIM-1 Inhibitors with PharmScreen

Pim-1 is an oncogene-encoded serine/threonine kinase. Originally identified in Maloney murine leukaemia,

December 6, 2017 No Comments

Publications

Are medicinal chemistry CRO complementing their technology with computational chemistry?

Computational chemistry has been embraced by drug discovery as a key complementary

November 22, 2017 No Comments

Science

Ligand-based or structure-based virtual screening?

Virtual screening is a well-known approach in drug discovery projects to find

November 10, 2017 No Comments

Scripts

RDKit conformation generation script

By Alessandro Deplano – Sep. 20, 2017 NOTE: THERE IS A NEW

September 20, 2017 No Comments

Events

RDKit User Group Meeting

Enric Herrero, Pharmacelera’s CTO, is giving a talk about conformation generation at

September 15, 2017 No Comments

Upgrades

New user interface for PharmScreen

Check out our new user interface for PharmScreen! Perform virtual screening campaigns

August 9, 2017 No Comments

PharmScreen field-based alignment outperforms traditional solutions

PharmScreen field-based alignment outperforms traditional solutions by taking into account relevant ligand

August 5, 2017 No Comments

News

User experience for life sciences

Using scientific software can be frustrating and time-consuming if user experience has

July 19, 2017 No Comments

Quantum-mechanical descriptors

Does the accuracy of quantum-mechanical (QM) descriptors at density functional theory (DFT)

July 4, 2017 No Comments

Learn more about what we are doing and where are we going. Read about our perspective on current topics related to science, pharma and innovation.

Recent posts

How computational chemistry tools can help drug repurposing?

Fragment Based Drug Design and Field-Based Technology

PharmScreen GUI v2.0 released: faster and easier! Request a demo

HPC opportunities in Europe for Life Sciences

What is Eroom’s Law?

Are you considering tautomerism, ionization and chirality when identifying new hits?

Bosch i Gimpera Foundation Award

Alignment of PIM-1 Inhibitors with PharmScreen

Are medicinal chemistry CRO complementing their technology with computational chemistry?

Ligand-based or structure-based virtual screening?

RDKit conformation generation script

RDKit User Group Meeting

New user interface for PharmScreen

PharmScreen field-based alignment outperforms traditional solutions

User experience for life sciences

Quantum-mechanical descriptors

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Torre R, 4a planta, Despatx A05, Parc Científic de Barcelona (PCB). C/ Baldiri Reixac 4-8 08028 Barcelona

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Contact: Luca Sartori
Via G. Ferrari 14, 36100 Vicenza - Italy

Blog

Learn more about what we are doing and where are we going. Read about our perspective on current topics related to science, pharma and innovation.

Recent posts

SITEMAP

SOCIAL

Contact

CONTACT INFORMATION

HEADQUARTERS

Torre R, 4a planta, Despatx A05, Parc Científic de Barcelona (PCB). C/ Baldiri Reixac 4-8 08028 Barcelona

ITALY S-IN Soluzioni Informatiche

Contact: Luca SartoriVia G. Ferrari 14, 36100 Vicenza - Italy

Contact: Luca Sartori
Via G. Ferrari 14, 36100 Vicenza - Italy