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Application

Discovery Studio 1.0 Materials Studio 0.47384219554030876 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.049393414211438474 Amorphous Cell 0.1854419410745234 Blends 0.0 CASTEP 0.2668977469670711 CDOCKER 0.36395147313691506 CHARMm 0.45493934142114384 COMPASS 0.2781629116117851 COMPASS III 0.07019064124783363 COSMObase 8.665511265164644E-4 COSMOperm 0.0 COSMOquick 0.0017331022530329288 COSMOtherm 0.03726169844020797 Catalyst 0.23570190641247835 Classical Simulations 1.0 Crystallization 0.04852686308492201 DMol3 0.12218370883882149 DPD 0.0017331022530329288 Discover 0.0 Forcite 0.3934142114384749 GULP 0.006065857885615251 LUDI 0.008665511265164644 LibDock 0.12738301559792028 LigandFit 0.008665511265164644 MCSS 8.665511265164644E-4 MODELER 0.4090121317157712 MesoDyn 0.0 Mesocite 0.0017331022530329288 Mesoscale 0.004332755632582322 Morphology 0.00779896013864818 ONETEP 0.0 Polymorph 0.0034662045060658577 QSAR 0.0 Quantum Mechanics 0.3847487001733102 Reflex 0.036395147313691506 Reflex Plus 0.0 Sorption 0.022530329289428077 Visualization 0.9332755632582322 X-Cell 0.0 ZDOCK 0.038128249566724434

Year

2023 0.01801278326554329 2024 0.7309703660662406 2025 1.0 2026 0.32771644392794885 2027 0.0

Keywords

novel 1.0 target 0.9428474805546162 potential 0.3818058843422388 docking 0.33107879607710516 analysis 0.18566114305038892 visualization 0.15759215421034833 promising 0.13933040243490025 synthesized 0.12952316537030775 binding 0.10213053770713561 activity 0.09942509299966182 development 0.09299966181941156 synthesis 0.08826513358133244 compound 0.0693270206290159 between 0.06526885356780521 therapeutic 0.034494420020290836 vitro 0.021981738248224553 effective 0.020290835306053433 protein 0.016909029421711193 stability 0.013865404125803178 design 0.012850862360500507 drug 0.011159959418329387 potent 0.007101792357118702 inhibition 0.006763611768684477 cell 0.0047345282380791345 including 0.0
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