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Application

Discovery Studio 0.9884726224783862 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0579465541490858 Amorphous Cell 0.27960618846694796 Blends 0.0014064697609001407 CASTEP 0.35246132208157527 CDOCKER 0.16736990154711673 CHARMm 0.2542897327707454 COMPASS 0.35555555555555557 COMPASS III 0.10154711673699016 COSMObase 0.004219409282700422 COSMOconf 0.005063291139240506 COSMOmic 2.8129395218002813E-4 COSMOperm 0.0014064697609001407 COSMOplex 2.8129395218002813E-4 COSMOquick 0.0011251758087201125 COSMOtherm 0.06835443037974684 Catalyst 0.10042194092827005 Classical Simulations 1.0 Conformers 2.8129395218002813E-4 Crystallization 0.07257383966244725 DFTB Plus 0.006188466947960619 DMol3 0.1620253164556962 DPD 0.002250351617440225 Discover 0.001969057665260197 Forcite 0.5406469760900141 GULP 0.021659634317862168 Kinetix 2.8129395218002813E-4 LUDI 0.002531645569620253 LibDock 0.07032348804500703 LigandFit 0.004219409282700422 MODELER 0.23825597749648383 MesoDyn 2.8129395218002813E-4 Mesocite 0.001969057665260197 Mesoscale 0.00450070323488045 Modules 0.0 Morphology 0.01828410689170183 ONETEP 0.0011251758087201125 Polymorph 0.002250351617440225 QMERA 0.0 QSAR 5.625879043600563E-4 Quantum Mechanics 0.5057665260196906 Reflex 0.05063291139240506 Reflex Plus 0.0016877637130801688 Semi-empirical 0.007594936708860759 Sorption 0.062165963431786216 Synthia 0.001969057665260197 TURBOMOLE 0.0 VAMP 8.438818565400844E-4 Visualization 0.7690576652601969 X-Cell 8.438818565400844E-4 ZDOCK 0.026160337552742614

Year

2023 0.11144321093082835 2024 0.5012809564474808 2025 1.0 2026 0.4555935098206661 2027 0.0

Keywords

target 1.0 potential 0.2964613034623218 docking 0.21779531568228105 analysis 0.2079938900203666 visualization 0.1864816700610998 between 0.15414969450101834 novel 0.1029786150712831 energy 0.08935845213849287 promising 0.07815682281059064 binding 0.07026476578411406 cell 0.06657331975560081 activity 0.0554989816700611 stability 0.041878818737270875 performance 0.04124236252545825 synthesized 0.03195010183299389 experimental 0.02494908350305499 including 0.023930753564154784 interaction 0.023930753564154784 development 0.02240325865580448 effective 0.021766802443991852 mechanism 0.0199847250509165 protein 0.01120162932790224 synthesis 0.00980142566191446 enhanced 0.006491853360488798 design 0.0
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