Mangesh Damre
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Research Keywords and Expertise
Molecular Dynamics
Coarse-grained MD
Protein
Drug Design
Molecular Docking
Virtual Screening
3D-QSAR
Homology Modelling
Membrane Simulations
Martini Forcefield
LBDD
SBDD
Chemoinformatics
Forcefield Parameterization
Free Energy Calculation
Interests
Molecular Dynamics; Coarse-grained MD; Protein; Drug Design; Molecular Docking; Virtual Screening; 3D-QSAR; Homology Modelling; Membrane Simulations; Martini Forcefield; LBDD; SBDD; Chemoinformatics; Forcefield Parameterization; Free Energy Calculation
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