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Application

Discovery Studio 0.8072289156626506 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06679903559778755 Amorphous Cell 0.29343355552403916 Blends 0.0022691816763579634 CASTEP 0.382782584030634 CDOCKER 0.14310026946532406 CHARMm 0.23046376400510565 COMPASS 0.3653382498936321 COMPASS III 0.09729116437384767 COSMObase 0.0041128917883988085 COSMOconf 0.005389306481350163 COSMOmic 0.0 COSMOperm 9.92766983406609E-4 COSMOplex 1.4182385477237272E-4 COSMOquick 0.0015600624024961 COSMOtherm 0.06665721174301517 Cantera 0.0 Catalyst 0.08027230180116296 Classical Simulations 1.0 Conformers 4.254715643171181E-4 Crystallization 0.0743156999007233 DFTB Plus 0.005814778045667281 DMol3 0.17061409729116436 DPD 0.002552829385902709 Discover 0.0038292440788540633 Forcite 0.5572259254006524 GULP 0.021273578215855907 Kinetix 2.8364770954474543E-4 LUDI 0.0032619486597645726 LibDock 0.06169337682598213 LigandFit 0.0035455963693093178 MCSS 4.254715643171181E-4 MODELER 0.21174301517515245 MesoDyn 8.509431286342362E-4 Mesocite 0.002978300950219827 Mesoscale 0.005814778045667281 Modules 0.0 Morphology 0.0171606864274571 ONETEP 0.0011345908381789817 Polymorph 0.001985533966813218 QMERA 1.4182385477237272E-4 QSAR 9.92766983406609E-4 Quantum Mechanics 0.5423344206495533 Reflex 0.05417671252304638 Reflex Plus 0.0011345908381789817 Semi-empirical 0.007374840448163381 Sorption 0.05914054744007942 Synthia 0.0012764146929513545 TURBOMOLE 4.254715643171181E-4 VAMP 0.0011345908381789817 Visualization 0.6654375265919728 X-Cell 0.001418238547723727 ZDOCK 0.024819174585165225

Year

2023 0.056400506970849175 2024 0.43578369243768483 2025 1.0 2026 0.44877482044782424 2027 0.0

Keywords

target 1.0 potential 0.2856852791878173 analysis 0.19884940778341795 docking 0.1855160744500846 between 0.16331641285956006 visualization 0.15478849407783418 energy 0.10111675126903553 novel 0.09576988155668359 promising 0.07519458544839255 cell 0.07133671742808799 binding 0.05793570219966159 performance 0.052521150592216584 stability 0.04406091370558376 activity 0.04101522842639594 experimental 0.03147208121827411 including 0.022470389170896787 synthesized 0.021184433164128595 interaction 0.02050761421319797 effective 0.020372250423011846 mechanism 0.017800338409475466 development 0.016988155668358713 enhanced 0.016175972927241964 design 0.00521150592216582 strong 0.003045685279187817 synthesis 0.0
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