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Application

Discovery Studio 0.9491421568627451 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05960769377261474 Amorphous Cell 0.2888973528851647 Blends 0.0022852789944772423 CASTEP 0.33917349076366404 CDOCKER 0.16377832793753572 CHARMm 0.2588078461245477 COMPASS 0.3450771281660636 COMPASS III 0.10607503332698534 COSMObase 0.004951437821367358 COSMOconf 0.00609407731860598 COSMOmic 0.0 COSMOperm 3.8087983241287375E-4 COSMOplex 1.9043991620643687E-4 COSMOquick 0.0013330794134450582 COSMOtherm 0.06627309083984002 Catalyst 0.0805560845553228 Classical Simulations 1.0 Conformers 3.8087983241287375E-4 Crystallization 0.07141496857741382 DFTB Plus 0.003999238240335174 DMol3 0.15616073128927824 DPD 0.0020948390782708055 Discover 0.0038087983241287373 Forcite 0.533993525042849 GULP 0.01942487145305656 Kinetix 1.9043991620643687E-4 LUDI 0.0036183584079223004 LibDock 0.06855836983431728 LigandFit 0.003999238240335174 MCSS 1.9043991620643687E-4 MODELER 0.24509617215768426 MesoDyn 5.713197486193106E-4 Mesocite 0.002856598743096553 Mesoscale 0.005332317653780233 Modules 0.0 Morphology 0.016758712626166444 ONETEP 9.521995810321843E-4 Polymorph 0.0022852789944772423 QMERA 1.9043991620643687E-4 QSAR 7.617596648257475E-4 Quantum Mechanics 0.48581222624262044 Reflex 0.051228337459531516 Reflex Plus 7.617596648257475E-4 Semi-empirical 0.005713197486193106 Sorption 0.058845934107788996 Synthia 0.0011426394972386211 TURBOMOLE 1.9043991620643687E-4 VAMP 0.0011426394972386211 Visualization 0.6918682155779852 X-Cell 0.0011426394972386211 ZDOCK 0.027804227766139784

Year

2023 1.508523155830442E-4 2024 0.44109217076482127 2025 1.0 2026 0.6358425101825314 2027 0.0

Keywords

target 1.0 potential 0.3010989010989011 docking 0.21272893772893772 analysis 0.21217948717948718 visualization 0.16135531135531136 between 0.14945054945054945 novel 0.0967032967032967 promising 0.08452380952380953 energy 0.08443223443223444 binding 0.06996336996336996 cell 0.06684981684981685 activity 0.046703296703296704 performance 0.04496336996336996 stability 0.041666666666666664 including 0.024175824175824177 synthesized 0.019413919413919414 experimental 0.019230769230769232 development 0.0184981684981685 effective 0.018406593406593407 mechanism 0.016483516483516484 enhanced 0.013827838827838827 interaction 0.010347985347985348 strong 0.00934065934065934 design 0.0019230769230769232 protein 0.0
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