Ligand-Protein Cross-Docking with Water MoleculesTHILAGAVATHI, Ramasamy; MANCERA, Ricardo L.Journal of chemical information and modeling. 2010, Vol 50, Num 3, pp 415-421, issn 1549-9596, 7 p.Article

Molecular Dynamics Simulations of CXCL-8 and Its Interactions with a Receptor Peptide, Heparin Fragments, and Sulfated Linked CyclitolsGANDHI, Neha S; MANCERA, Ricardo L.Journal of chemical information and modeling. 2011, Vol 51, Num 2, pp 335-358, issn 1549-9596, 24 p.Article

Assessment of multiple binding modes in ligand-protein dockingKÄLLBLAD, Per; MANCERA, Ricardo L; TODOROV, Nikolay P et al.Journal of medicinal chemistry (Print). 2004, Vol 47, Num 13, pp 3334-3337, issn 0022-2623, 4 p.Article

New Anti-Tuberculosis Drugs with Novel Mechanisms of ActionRIVERS, Emma C; MANCERA, Ricardo L.Current medicinal chemistry. 2008, Vol 15, Num 19, pp 1956-1967, issn 0929-8673, 12 p.Article

The emerging application of ultrasound in lactose crystallisationZAMANIPOOR, Mohammad H; MANCERA, Ricardo L.Trends in food science & technology (Regular ed.). 2014, Vol 38, Num 1, pp 47-59, issn 0924-2244, 13 p.Article

Heparin/heparan sulphate-based drugsGANDHI, Neha S; MANCERA, Ricardo L.Drug discovery today. 2010, Vol 15, Num 23-24, pp 1058-1069, issn 1359-6446, 12 p.Article

Calculations of the Free Energy of Interaction of the c-Fos-c-Jun Coiled Coil: Effects of the Solvation Model and the Inclusion of Polarization EffectsZHILI ZUO; GANDHI, Neha S; MANCERA, Ricardo L et al.Journal of chemical information and modeling. 2010, Vol 50, Num 12, pp 2201-2212, issn 1549-9596, 12 p.Article

New anti-tuberculosis drugs in clinical trials with novel mechanisms of actionRIVERS, Emma C; MANCERA, Ricardo L.Drug discovery today. 2008, Vol 13, Num 23-24, pp 1090-1098, issn 1359-6446, 9 p.Article

A new method for estimating the importance of hydrophobic groups in the binding site of a proteinKELLY, Matthew D; MANCERA, Ricardo L.Journal of medicinal chemistry (Print). 2005, Vol 48, Num 4, pp 1069-1078, issn 0022-2623, 10 p.Article

Molecular dynamics simulation of dilute aqueous DMSO solutions. A temperature-dependence study of the hydrophobic and hydrophilic behaviour around DMSOMANCERA, Ricardo L; CHALARIS, Michalis; REFSON, Keith et al.PCCP. Physical chemistry chemical physics (Print). 2004, Vol 6, Num 1, pp 94-102, issn 1463-9076, 9 p.Article

The Effects of Cryosolvents on DOPC―β-Sitosterol Bilayers Determined from Molecular Dynamics SimulationsHUGHES, Zak E; MALAJCZUK, Chris J; MANCERA, Ricardo L et al.The Journal of physical chemistry. B. 2013, Vol 117, Num 12, pp 3362-3375, issn 1520-6106, 14 p.Article

A molecular mechanism of solvent cryoprotection in aqueous DMSO solutionsMANDUMPAL, Jestin B; KRECK, Cara A; MANCERA, Ricardo L et al.PCCP. Physical chemistry chemical physics (Print). 2011, Vol 13, Num 9, pp 3839-3842, issn 1463-9076, 4 p.Article

CRYOPRESERVATION OF LOMANDRA SONDERI (ASPARAGACEAE) SHOOT TIPS USING DROPLET-VITRIFICATIONMENON, Akshay; FUNNEKOTTER, Bryn; KACZMARCZYK, Anja et al.Cryo-letters. 2012, Vol 33, Num 4, pp 259-270, issn 0143-2044, 12 p.Article

Novel structural features of CDK inhibition revealed by an ab initio computational method combined with dynamic simulationsHEADY, Lucy; FERNANDEZ-SERRA, Marivi; MANCERA, Ricardo L et al.Journal of medicinal chemistry (Print). 2006, Vol 49, Num 17, pp 5141-5153, issn 0022-2623, 13 p.Article