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Application

Discovery Studio 1.0 Materials Studio 0.9712528989806375 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06788608818499517 Amorphous Cell 0.27555952115398913 Blends 0.002825488883931891 CASTEP 0.4143802513198007 CDOCKER 0.1786749944233772 CHARMm 0.2607628819986616 COMPASS 0.37363372741467765 COMPASS III 0.0727191612759313 COSMObase 0.002825488883931891 COSMOconf 0.0032716187077106106 COSMOmic 2.2306491188935982E-4 COSMOperm 0.0012640345007063722 COSMOplex 3.71774853148933E-4 COSMOquick 0.0015614543832255187 COSMOtherm 0.06282995018216968 Cantera 7.43549706297866E-5 Catalyst 0.12186779686222024 Classical Simulations 1.0 Conformers 0.0010409695888170124 Crystallization 0.0760651349542717 DFTB Plus 0.005874042679753141 DMol3 0.1898282400178452 DPD 0.0031229087664510374 Discover 0.004610008179046769 Forcite 0.5314893300617146 GULP 0.026544724514833817 Kinetix 2.2306491188935982E-4 LUDI 0.0054279128559744216 LibDock 0.07190125659900365 LigandFit 0.00788162688675738 MCSS 0.0012640345007063722 MODELER 0.19243066398988773 MesoDyn 0.0015614543832255187 Mesocite 0.004238233325897837 Mesoscale 0.007732916945497806 Modules 0.0 Morphology 0.01754777306862964 ONETEP 0.0013383894713361588 Polymorph 0.001858874265744665 QMERA 2.2306491188935982E-4 QSAR 0.0014127444419659455 Quantum Mechanics 0.5918655662131014 Reflex 0.05636106773737824 Reflex Plus 6.691947356680794E-4 Semi-empirical 0.007955981857387166 Sorption 0.05398170867722507 Synthia 0.0014127444419659455 TURBOMOLE 5.204847944085062E-4 VAMP 0.001710164324485092 Visualization 0.8931519072049967 X-Cell 0.0011896795300765856 ZDOCK 0.03085731281136144

Year

2020 0.03813739678215715 2021 0.21503362560653783 2022 0.2944581595300928 2023 0.4436877500638461 2024 1.0 2025 0.9736102834766324 2026 0.36187962884140634 2027 0.0

Keywords

target 1.0 potential 0.25808855492765326 docking 0.2154567471899646 visualization 0.21365584052660994 analysis 0.17546419921753711 between 0.15077935788362418 novel 0.0995466683226728 energy 0.08026454697882382 binding 0.06871390424144569 cell 0.056418058746817365 activity 0.052164193007514126 promising 0.04207290566975098 interaction 0.03968204682357325 synthesized 0.028162454201080545 experimental 0.027137800409861516 stability 0.024622741104142084 protein 0.019965223871328323 mechanism 0.016736011923244115 effective 0.01633236042973359 development 0.015245606408743713 synthesis 0.01242004595417003 performance 0.01235794572439918 including 0.0055890206793765135 chemical 0.001987207352667205 design 0.0
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