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Application

Discovery Studio 0.9938809131560367 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05887323943661972 Amorphous Cell 0.28338028169014085 Blends 0.001971830985915493 CASTEP 0.31661971830985913 CDOCKER 0.163943661971831 CHARMm 0.26873239436619717 COMPASS 0.3391549295774648 COMPASS III 0.10647887323943662 COSMObase 0.004788732394366197 COSMOconf 0.007042253521126761 COSMOmic 0.0 COSMOperm 5.633802816901409E-4 COSMOplex 2.8169014084507044E-4 COSMOquick 8.450704225352113E-4 COSMOtherm 0.06563380281690141 Catalyst 0.07492957746478873 Classical Simulations 1.0 Conformers 2.8169014084507044E-4 Crystallization 0.07098591549295774 DFTB Plus 0.0022535211267605635 DMol3 0.14676056338028168 DPD 0.0011267605633802818 Discover 0.004225352112676056 Forcite 0.5242253521126761 GULP 0.017464788732394366 Kinetix 0.0 LUDI 0.004507042253521127 LibDock 0.07014084507042254 LigandFit 0.0036619718309859155 MCSS 5.633802816901409E-4 MODELER 0.2535211267605634 MesoDyn 5.633802816901409E-4 Mesocite 0.0030985915492957746 Mesoscale 0.004788732394366197 Morphology 0.016338028169014085 ONETEP 5.633802816901409E-4 Polymorph 0.0016901408450704226 QMERA 0.0 QSAR 5.633802816901409E-4 Quantum Mechanics 0.4540845070422535 Reflex 0.05211267605633803 Reflex Plus 0.0 Semi-empirical 0.003943661971830986 Sorption 0.055492957746478874 Synthia 8.450704225352113E-4 TURBOMOLE 0.0 VAMP 0.0011267605633802818 Visualization 0.6825352112676056 X-Cell 0.0016901408450704226 ZDOCK 0.029014084507042254

Year

2024 0.23765635286372613 2025 1.0 2026 0.7750713188501207 2027 0.0

Keywords

target 1.0 potential 0.3158860045146727 docking 0.22107787810383747 analysis 0.2175507900677201 visualization 0.15886004514672686 between 0.14094243792325056 novel 0.09367945823927765 promising 0.08845936794582393 binding 0.07646726862302483 energy 0.07096501128668171 cell 0.061512415349887134 activity 0.04288939051918736 stability 0.04020880361173815 performance 0.03668171557562077 including 0.024830699774266364 strong 0.020457110609480814 effective 0.01368510158013544 development 0.013544018058690745 enhanced 0.011286681715575621 mechanism 0.009734762979683972 synthesized 0.006630925507900677 experimental 0.006207674943566591 interaction 0.0018340857787810384 design 4.2325056433408577E-4 strategy 0.0
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