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Application

Discovery Studio 0.9825718323127649 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05211190345584202 Amorphous Cell 0.2797586396050466 Blends 5.485463521667581E-4 CASTEP 0.2786615469007131 CDOCKER 0.15962698848052662 CHARMm 0.2550740537575425 COMPASS 0.34503565551289084 COMPASS III 0.11464618760285245 COSMObase 0.004936917169500823 COSMOconf 0.00877674163466813 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 5.485463521667581E-4 COSMOquick 5.485463521667581E-4 COSMOtherm 0.06801974766867801 Catalyst 0.07295666483817882 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07899067471201317 DFTB Plus 0.004388370817334065 DMol3 0.1321996708721887 DPD 0.0021941854086670325 Discover 0.0038398244651673065 Forcite 0.5304443225452551 GULP 0.01426220515633571 Kinetix 0.0 LUDI 0.0032912781130005485 LibDock 0.06472846955567746 LigandFit 0.0027427317608337905 MODELER 0.2534284147010422 Mesocite 0.0032912781130005485 Mesoscale 0.005485463521667581 Morphology 0.018650575973669776 ONETEP 0.0010970927043335162 Polymorph 0.0021941854086670325 QMERA 0.0 Quantum Mechanics 0.40537575425123423 Reflex 0.055403181568842566 Reflex Plus 5.485463521667581E-4 Semi-empirical 0.005485463521667581 Sorption 0.06527701590784421 Synthia 0.0010970927043335162 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.6653867251782776 X-Cell 5.485463521667581E-4 ZDOCK 0.024136039495337356

Year

2024 0.08886894075403949 2025 0.9596050269299821 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.31627906976744186 analysis 0.2302325581395349 docking 0.22238372093023256 visualization 0.1625 between 0.12994186046511627 promising 0.09505813953488372 novel 0.08691860465116279 binding 0.07703488372093023 energy 0.07441860465116279 cell 0.06279069767441861 stability 0.043313953488372095 activity 0.04040697674418604 performance 0.039825581395348836 including 0.02703488372093023 strong 0.022093023255813953 synthesized 0.015406976744186047 effective 0.015116279069767442 strategy 0.014534883720930232 enhanced 0.010465116279069767 mechanism 0.009593023255813954 development 0.00872093023255814 design 0.0020348837209302325 experimental 0.0 therapeutic 0.0
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