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Application

Discovery Studio 1.0 Materials Studio 0.9454852004496066 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05843387745445943 Amorphous Cell 0.27324343506032645 Blends 0.0021291696238466998 CASTEP 0.3196120179796546 CDOCKER 0.17695765318192572 CHARMm 0.2827064111663118 COMPASS 0.330967589306837 COMPASS III 0.1050390347764372 COSMObase 0.0049680624556423 COSMOconf 0.005914360066240833 COSMOmic 0.0 COSMOperm 4.731488052992666E-4 COSMOplex 2.365744026496333E-4 COSMOquick 7.097232079489E-4 COSMOtherm 0.06529453513129879 Catalyst 0.0823278921220724 Classical Simulations 1.0 Conformers 4.731488052992666E-4 Crystallization 0.07073574639224035 DFTB Plus 0.0035486160397444995 DMol3 0.149041873669269 DPD 0.0026023184291459663 Discover 0.0047314880529926665 Forcite 0.5136030281523539 GULP 0.017743080198722498 Kinetix 2.365744026496333E-4 LUDI 0.0040217648450437665 LibDock 0.07333806482138633 LigandFit 0.003785190442394133 MODELER 0.26354388455169153 MesoDyn 7.097232079489E-4 Mesocite 0.003075467234445233 Mesoscale 0.006150934468890466 Modules 0.0 Morphology 0.017033356990773598 ONETEP 9.462976105985332E-4 Polymorph 0.0021291696238466998 QMERA 2.365744026496333E-4 QSAR 4.731488052992666E-4 Quantum Mechanics 0.45966406434823753 Reflex 0.050390347764371894 Reflex Plus 7.097232079489E-4 Semi-empirical 0.0047314880529926665 Sorption 0.05488526141471493 Synthia 0.0011828720132481666 TURBOMOLE 0.0 VAMP 4.731488052992666E-4 Visualization 0.7203690560681334 X-Cell 0.0014194464158978 ZDOCK 0.029808374733853796

Year

2023 0.0 2024 0.39634383508362503 2025 1.0 2026 0.7913263321664722 2027 0.0019447685725398677

Keywords

target 1.0 potential 0.31075194864740946 docking 0.2359009628610729 analysis 0.22329206785878036 visualization 0.17125171939477304 between 0.14477303988995874 novel 0.09617148097203118 promising 0.09032553874369555 binding 0.08161393856029345 energy 0.06980742778541953 cell 0.06109582760201742 activity 0.053874369555249886 stability 0.04298486932599725 performance 0.03599266391563503 including 0.023269142595139843 effective 0.01879871618523613 development 0.018569463548830812 synthesized 0.017996331957817514 mechanism 0.013296652911508482 strong 0.012838147638697846 enhanced 0.011004126547455296 experimental 0.010660247592847318 interaction 0.008826226501604768 protein 0.005845942228335626 design 0.0
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