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Application

Discovery Studio 0.9597668945421943 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06312952191800256 Amorphous Cell 0.28344446020712155 Blends 0.0019860973187686196 CASTEP 0.35650446871896724 CDOCKER 0.1601645623492694 CHARMm 0.2601787487586892 COMPASS 0.3521066817988367 COMPASS III 0.0954745353950915 COSMObase 0.0041140587317349975 COSMOconf 0.004965243296921549 COSMOmic 1.4186409419775854E-4 COSMOperm 7.093204709887927E-4 COSMOplex 1.4186409419775854E-4 COSMOquick 0.001560505036175344 COSMOtherm 0.06539934742516669 Catalyst 0.09675131224287133 Classical Simulations 1.0 Conformers 4.2559228259327563E-4 Crystallization 0.07036459072208824 DFTB Plus 0.004681515108526032 DMol3 0.16129947510285148 DPD 0.0019860973187686196 Discover 0.003546602354943964 Forcite 0.5356788196907363 GULP 0.019719109093488438 Kinetix 1.4186409419775854E-4 LUDI 0.003404738260746205 LibDock 0.06625053199035325 LigandFit 0.004255922825932757 MCSS 4.2559228259327563E-4 MODELER 0.23435948361469713 MesoDyn 5.674563767910342E-4 Mesocite 0.003121010072350688 Mesoscale 0.005390835579514825 Modules 0.0 Morphology 0.01673996311533551 ONETEP 8.511845651865513E-4 Polymorph 0.0019860973187686196 QMERA 1.4186409419775854E-4 QSAR 7.093204709887927E-4 Quantum Mechanics 0.5077315931337778 Reflex 0.0506454816285998 Reflex Plus 0.0011349127535820683 Semi-empirical 0.006242020144701376 Sorption 0.056178181302312384 Synthia 8.511845651865513E-4 TURBOMOLE 4.2559228259327563E-4 VAMP 0.0011349127535820683 Visualization 0.7362746488863668 X-Cell 0.0017023691303731025 ZDOCK 0.026670449709178607

Year

2023 0.08654262224145391 2024 0.49718736477715275 2025 1.0 2026 0.45964950237992214 2027 0.0

Keywords

target 1.0 potential 0.2941408302679979 docking 0.21452968996321597 analysis 0.20533368365738308 visualization 0.17492117708880714 between 0.1519968470835523 novel 0.09898843930635838 energy 0.08434051497635313 promising 0.07310825013137152 binding 0.06936416184971098 cell 0.06391224382553862 activity 0.04854177614293221 stability 0.04046242774566474 performance 0.03711245401996847 experimental 0.022004729374671572 synthesized 0.022004729374671572 including 0.021019442984760904 interaction 0.019968470835522858 effective 0.017603783499737256 development 0.017012611665790857 mechanism 0.016487125591171835 protein 0.0076195480819758275 enhanced 0.007356805044666317 synthesis 0.0035470310036784026 design 0.0
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